Crystallography Open Database
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Searching journal of publication like 'Acta Crystallographica B (24,1968-38,1982)'
COD ID  |
Links | Formula |
Space group |
Cell parameters | Cell volume  |
Bibliography |
|---|---|---|---|---|---|---|
| 1000429 | CIF | Ba0.83 Ca2.1 In6 O12 | P 3 | 9.888; 9.888; 3.217 90; 90; 120 | 272.4 | Baldinozzi, G; Goutenoire, F; Hervieu, M; Suard, E; Grebille, D Incommensurate modulated disorder in Ba0.85 Ca2.15 In6 O12 Acta Crystallographica B (39,1983-), 1996, 52, 780-789 |
| 2104155 | CIF Paper | D4 Ge | P 21 21 21 | 7.35565; 8.15934; 4.53932 90; 90; 90 | 272.437 | Maley, Iain J.; Brown, Daniel H.; Ibberson, Richard M.; Pulham, Colin R. Solid-state structures of the covalent hydrides germane and stannane Acta Crystallographica Section B, 2008, 64, 312-317 |
| 2100656 | CIF Paper | F3 Fe | R -3 c :H | 4.84; 4.84; 13.4413 90; 90; 120 | 272.69 | Jørgensen, Jens-Erik; Smith, R. I. On the compression mechanism of FeF~3~ Acta Crystallographica Section B, 2006, 62, 987-992 |
| 2103919 | CIF Paper | C Na2 O3 | 8.898; 5.237; 5.996 90; 101.87; 90 | 273.4 | Dusek, Michal; Chapuis, Gervais; Meyer, Mathias; Petricek, Vaclav Sodium carbonate revisited Acta Crystallographica Section B, 2003, 59, 337-352 | |
| 9011305 | CIF | C Na2 O3 | C 1 2/m 1 | 8.898; 5.237; 5.996 90; 101.87; 90 | 273.432 | Dusek, M.; Chapuis, G.; Meyer, M.; Petricek, V. Sodium carbonate revisited Sample: Delta phase, T = 110 K Acta Crystallographica, Section B, 2003, 59, 337-352 |
| 1001224 | CIF | Ge2 N2 O | C m c 21 | 9.312; 5.755; 5.105 90; 90; 90 | 273.6 | Jorgensen, J D; Srinivasa, S R; Labbe, J C; Roult, G Time-of-flight neutron diffraction study of germanium nitride oxide, Ge~2~ N~2~ O Acta Crystallographica B (24,1968-38,1982), 1979, 35, 141-142 |
| 2106733 | CIF | Cl2 H2 O3 U | P 1 21/m 1 | 5.828; 8.534; 5.557 90; 97.79; 90 | 273.833 | Taylor, J.C.; Wilson, P.W. The structure of uranyl chloride monohydrate by neutron diffraction and the disorder of the water molecule Acta Crystallographica B (24,1968-38,1982), 1974, 30, 169-175 |
| 2103513 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 7.944; 7.944; 5.012 90; 90; 120 | 273.9 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2103514 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 7.944; 7.944; 5.012 90; 90; 120 | 273.9 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2102849 | CIF Paper | Bi2 Ge2 Te5 | P -3 m 1 | 4.28072; 4.28072; 17.2651 90; 90; 120 | 273.99 | Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kifune, Kouichi; Kubota, Yoshiki; Takata, Masaki Crystal structures of stable and metastable Ge~2~Bi~2~Te~5~, an intermetallic compound in a GeTe-Bi~2~Te~3~ pseudobinary system Acta Crystallographica, Section B, 2007, 63, 346-352 |
| 9011136 | CIF | Lu O4 P | I 41/a m d :2 | 6.792; 6.792; 5.955 90; 90; 90 | 274.712 | Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C. Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic Note: isostructural with xenotime-(Y) Acta Crystallographica, Section B, 1973, 29, 141-142 |
| 2103510 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 7.953; 7.953; 5.023 90; 90; 120 | 275.1 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2103511 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 7.953; 7.953; 5.023 90; 90; 120 | 275.1 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2105026 | CIF HKL Paper | C4 H6 O4 | P 1 21/n 1 | 3.851; 11.84; 6.227 90; 104.31; 90 | 275.1 | Joseph, Sumy; Sathishkumar, Ranganathan; Mahapatra, Sudarshan; Desiraju, Gautam R. Crystal packing and melting temperatures of small oxalate esters: the role of C—H···O hydrogen bonding Acta Crystallographica Section B, 2011, 67, 525-534 |
| 2105342 | CIF | Ag I | P 63 m c | 4.5979; 4.5979; 15.029 90; 90; 120 | 275.156 | Schock, R.N.; Johnson, Q. The 4h polytype of silver iodide Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1482-1483 |
| 2107437 | CIF | Ca Cl4 Cs2 H4 O2 | P -1 | 6.9038; 7.5127; 5.8774 92.28; 96.19; 65.23 | 275.174 | Evans, Jr., H. T.; Konnert, J. A.; Chou, I. M.; Romankiw, L. A. A Crystal Chemical Study of the System CsCl-NaCl-H~2~O; Structures of the CsCl Derivative Compounds Cs~1-x~(NaH~2~O)~x~Cl, CsNa~2~Cl~3~(H~2~O)~2~, and Cs~2~CaCl~4~(H~2~O)~2~ Acta Crystallographica, Section B: Structural Science, 1984, 40, 86-92 |
| 9011319 | CIF | Cu0.298 Pb0.95 S3.36 Sb0.408 Sn0.851 | C -1 | 3.6661; 6.3138; 11.9028 92.49; 90.59; 89.986 | 275.24 | Evain, M.; Petricek, V.; Moelo, Y.; Maurel, C. First (3+2)-dimensional superspace approach to the structure of levyclaudite-(Sb), a member of the cylindrite-type minerals Acta Crystallographica, Section B, 2006, 62, 775-789 |
| 2108752 | CIF HKL | C4 H9 Na O | P 4/n m m :2 | 4.43232; 4.43232; 14.0143 90; 90; 90 | 275.317 | Beske, Maurice; Cronje, Stephanie; Schmidt, Martin U.; Tapmeyer, Lukas Disordered sodium alkoxides from powder data: crystal structures of sodium ethoxide, propoxide, butoxide and pentoxide, and some of their solvates Acta Crystallographica Section B, 2021, 77 |
| 9011099 | CIF | Cl Fe2 O12 Te4 | P -1 | 8.89; 5.08; 6.63 103.17; 107.08; 77.87 | 275.366 | Dusausoy, Y.; Protas, J. Determination et etude de la structure cristalline de la rodalquilarite, chlorotellurite acide de fer Acta Crystallographica, Section B, 1969, 25, 1551-1558 |
| 2100612 | CIF Paper | Cu0.299 Pb0.951 S3.357 Sb0.406 Sn0.851 | C -1 | 3.6733; 6.312; 11.9039 92.484; 90.687; 89.941 | 275.72 | M. Evain; V. Petricek; Y. Moëlo; C. Maurel First (3+2)-dimensional superspace approach to the structure of levyclaudite-(Sb), a member of the cylindrite-type minerals Acta Crystallographica Section B, 2006, 62, 775-789 |
| 2106734 | CIF | Cl2 D2 O3 U | P 1 21/m 1 | 5.847; 8.596; 5.543 90; 97.51; 90 | 276.206 | Taylor, J.C.; Wilson, P.W. The structure of Uranyl Chloride Monohydrate by neutron diffraction and the disorder of the water molecule Acta Crystallographica B (24,1968-38,1982), 1974, 30, 169-175 |
| 2102012 | CIF Paper | F Nb O2 | R -3 c | 4.8232; 4.8232; 13.7125 90; 90; 120 | 276.26 | Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E. High-pressure transformations of NbO~2~F Acta Crystallographica Section B, 2000, 56, 189-196 |
| 2102653 | CIF Paper | Cr F3 | R -3 c :H | 4.9106; 4.9106; 13.2286 90; 90; 120 | 276.26 | Jοrgensen, J.-E.; Marshall, W.G.; Smith, R.I. The compression mechanism of CrF~3~ Acta Crystallographica Section B, 2004, 60, 669-673 |
| 2103508 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 7.972; 7.972; 5.021 90; 90; 120 | 276.3 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2103509 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 7.972; 7.972; 5.021 90; 90; 120 | 276.3 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2106297 | CIF | C Na2 O3 | C 1 2/m 1 | 8.9; 5.24; 6.04 90; 101.2; 90 | 276.317 | Dubbeldam, G.C.; de Wolff, P.M. The average crystal structure of gamma Na2 C O3 Acta Crystallographica B (24,1968-38,1982), 1969, 25, 2665-2667 |
| 2100751 | CIF Paper | Al3 Zr | I 4/m m m | 3.9993; 3.9993; 17.283 90; 90; 90 | 276.43 | Ma, Y.; Rømming, C.; Lebech, B.; Gjønnes, J.; Taftø, J. Structure refinement of Al~3~Zr using single-crystal X-ray diffraction, powder neutron diffraction and CBED Acta Crystallographica Section B, 1992, 48, 11-16 |
| 2312499 | CIF | Ge4.158 N4 O4 Sn0.842 | P 63 m c | 5.839; 5.839; 9.365 90; 90; 120 | 276.51 | Gollé-Leidreiter, Philipp; Bhat, Shrikant; Wiehl, Leonore; Wen, Qingbo; Kroll, Peter; Ishikawa, Ryo; Etter, Martin; Farla, Robert; Ikuhara, Yuichi; Riedel, Ralf; Kolb, Ute Crystal structures of two new high-pressure oxynitrides with composition SnGe<sub>4</sub>N<sub>4</sub>O<sub>4</sub>, from single-crystal electron diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2107402 | CIF | Si2 Sr | P 43 3 2 | 6.515; 6.515; 6.515 90; 90; 90 | 276.531 | Pringle, G.E. The structure of Sr Si2: a crystal of class O (432) Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2326-2328 |
| 2104600 | CIF Paper | C6 H10 Cl2 N2 O8 | P -1 | 5.097; 7.1061; 8.7475 103.625; 103.274; 108.086 | 276.54 | Marsh, Richard E. Space groups <i>P</i>1 and <i>Cc</i>: how are they doing? Acta Crystallographica Section B, 2009, 65, 782-783 |
| 2104871 | CIF HKL Paper | As2 Mn2 O7 | C 1 2/m 1 | 6.7454; 8.7561; 4.8004 90; 102.723; 90 | 276.57 | Weil, Matthias; Stöger, Berthold Crystal chemistry of transition metal diarsenates <i>M</i>~2~As~2~O~7~ (<i>M</i> = Mn, Co, Ni, Zn): variants of the thortveitite structure Acta Crystallographica Section B, 2010, 66, 603-614 |
| 2003131 | CIF Paper | Nb0.5 O3 Sr Yb0.5 | P 1 21/n 1 | 5.79095; 5.8221; 8.20358 90; 90.1262; 90 | 276.59 | Yang, Jae Ho; Choo, Woong Kil; Lee, Jin Ho; Lee, Chang Hee The Crystal Structure of B-site Ordered Complex Perovskite SrYb~0.5~Nb~0.5~O~3~ Acta Crystallographica, Section B, 1999, 55, 348-354 |
| 2003132 | CIF Paper | Nb0.5 O3 Sr Yb0.5 | P 1 21/n 1 | 5.79095; 5.8221; 8.20358 90; 90.1262; 90 | 276.59 | Yang, Jae Ho; Choo, Woong Kil; Lee, Jin Ho; Lee, Chang Hee The Crystal Structure of B-site Ordered Complex Perovskite SrYb~0.5~Nb~0.5~O~3~ Acta Crystallographica, Section B, 1999, 55, 348-354 |
| 2104688 | CIF HKL Paper | Ca O6 Sr2 W | P 1 21/n 1 | 5.8; 5.813; 8.207 90; 89.966; 90 | 276.7 | Madariaga, G.; Faik, A.; Breczewski, T.; Igartua, J. M. Crystal growth and twinned crystal structure of Sr~2~CaWO~6~ Acta Crystallographica Section B, 2010, 66, 109-116 |
| 2106966 | CIF | Cd P2 | P n a 21 | 9.9; 5.408; 5.171 90; 90; 90 | 276.851 | Goodyear, J.; Steigmann, G.A. The crystal structure of alpha-Cd P2 Acta Crystallographica B (24,1968-38,1982), 1969, 25, 2371-2374 |
| 9011241 | CIF | Na O3 V | P n m a | 14.147; 3.6496; 5.364 90; 90; 90 | 276.948 | Kato, K.; Takayama, E. Das entwaesserungsverhalten des natriummetavanadatdihydrats und die kristallstruktur des beta-natriummetavanadats Note: anisoB's corrected from ICSD Acta Crystallographica, Section B, 1984, 40, 102-105 |
| 2103504 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 7.981; 7.981; 5.024 90; 90; 120 | 277.1 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2103505 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 7.981; 7.981; 5.024 90; 90; 120 | 277.1 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2108167 | CIF | D3 O4 P | P 1 21/c 1 | 5.403; 4.7036; 10.9238 90; 92.633; 90 | 277.32 | Bull, Craig L.; Funnell, Nicholas P.; Pulham, Colin R.; Marshall, William G.; Allan, David R. A new high-pressure polymorph of phosphoric acid Acta Crystallographica Section B, 2017, 73, 1068-1074 |
| 9007647 | CIF | Al0.08 Fe0.16 K0.65 Mn3.76 Na0.11 O8 Sr0.08 | I 1 2/m 1 | 9.956; 2.8705; 9.706 90; 90.95; 90 | 277.347 | Post, J. E.; Von Dreele, R. B.; Buseck, P. R. Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: -1M polytype Note: Anisotropic displacement factors from ICSD Acta Crystallographica, Section B, 1982, 38, 1056-1065 |
| 2100752 | CIF Paper | Al3 Zr | I 4/m m m | 4.0065; 4.0065; 17.284 90; 90; 90 | 277.44 | Ma, Y.; Rømming, C.; Lebech, B.; Gjønnes, J.; Taftø, J. Structure refinement of Al~3~Zr using single-crystal X-ray diffraction, powder neutron diffraction and CBED Acta Crystallographica Section B, 1992, 48, 11-16 |
| 9011304 | CIF | C Na2 O3 | C 1 2/m 1 | 8.92; 5.245; 6.05 90; 101.35; 90 | 277.516 | Dusek, M.; Chapuis, G.; Meyer, M.; Petricek, V. Sodium carbonate revisited Sample: Gamma phase, T = 295 K Acta Crystallographica, Section B, 2003, 59, 337-352 |
| 2103920 | CIF Paper | C Na2 O3 | 8.9195; 5.2454; 6.05 90; 101.354; 90 | 277.518 | Dusek, Michal; Chapuis, Gervais; Meyer, Mathias; Petricek, Vaclav Sodium carbonate revisited Acta Crystallographica Section B, 2003, 59, 337-352 | |
| 9011104 | CIF | O7 Si2 Yb2 | C 1 2/m 1 | 6.802; 8.875; 4.703 90; 102.12; 90 | 277.581 | Smolin, Y. I.; Shepelev, Y. F. The crystal structures of the rare earth pyrosilicates Acta Crystallographica, Section B, 1970, 26, 484-492 |
| 2105025 | CIF Paper | C4 H6 O4 | P 1 21/n 1 | 3.873; 11.875; 6.205 90; 103.37; 90 | 277.6 | Joseph, Sumy; Sathishkumar, Ranganathan; Mahapatra, Sudarshan; Desiraju, Gautam R. Crystal packing and melting temperatures of small oxalate esters: the role of C—H···O hydrogen bonding Acta Crystallographica Section B, 2011, 67, 525-534 |
| 2102850 | CIF Paper | Bi2 Ge2 Te5 | P -3 m 1 | 4.3004; 4.3004; 17.3659 90; 90; 120 | 278.13 | Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kifune, Kouichi; Kubota, Yoshiki; Takata, Masaki Crystal structures of stable and metastable Ge~2~Bi~2~Te~5~, an intermetallic compound in a GeTe-Bi~2~Te~3~ pseudobinary system Acta Crystallographica, Section B, 2007, 63, 346-352 |
| 2103506 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 7.991; 7.991; 5.037 90; 90; 120 | 278.5 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 9007692 | CIF | C Mg O3 | R -3 c :H | 4.632; 4.632; 15.002 90; 90; 120 | 278.751 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N. Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3 Acta Crystallographica, Section B, 1995, 51, 929-939 |
| 2106731 | CIF | Cl H6 Na O5 | P -1 | 5.492; 6.412; 8.832 72.06; 87.73; 70.88 | 278.921 | Tarimci, C.; Schempp, E. Sodium chlorite trihydrate Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2146-2149 |
| 2101878 | CIF Paper | Cl2 H12 O14 Zn | P 63 m c | 7.7959; 7.7959; 5.3033 90; 90; 120 | 279.13 | Soma Ghosh; Monika Mukherjee; Alpana Seal; Siddhartha Ray X-ray Study of <i>M</i>^II^(ClO~4~)~2~.6H~2~O (<i>M</i>^II^ = Zn, Ni): Twinning, Disorder and Phase Transitions Acta Crystallographica Section B, 1997, 53, 639-644 |
| 9011105 | CIF | Er2 O7 Si2 | P 1 1 21/b | 4.683; 5.556; 10.79 90; 90; 96 | 279.204 | Smolin, Y. I.; Shepelev, Y. F. The crystal structures of the rare earth pyrosilicates Acta Crystallographica, Section B, 1970, 26, 484-492 |
| 2022907 | CIF HKL Paper | B3 Ca H7 O9 | P -1 | 6.05; 7.4908; 6.7136 97.629; 107.773; 100.211 | 279.42 | Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite) Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945 |
| 2101057 | CIF Paper | C Mg O3 | R -3 c :H | 4.635; 4.635; 15.023 90; 90; 120 | 279.5 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R. X-ray study of the electron density in magnesite MgCO~3~ Acta Crystallographica Section B, 1993, 49, 980-984 |
| 1008322 | CIF | K1.33 Mn8 O16 | I 4/m | 9.866; 9.866; 2.872 90; 90; 90 | 279.6 | Vicat, J; Fanchon, E; Strobel, P; Tran Qui, D The Structure of K~1.33~ Mn~8~ O~16~ and Cation Ordering in Hollandite- Type Structures Acta Crystallographica B (39,1983-), 1986, 42, 162-167 |
| 2102011 | CIF Paper | F Nb O2 | R -3 c | 4.8552; 4.8552; 13.7 90; 90; 120 | 279.68 | Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E. High-pressure transformations of NbO~2~F Acta Crystallographica Section B, 2000, 56, 189-196 |
| 1001511 | CIF | Ba Ni O7 P2 | P -1 | 5.317; 7.58; 7.116 101.26; 84.48; 89.49 | 279.9 | Riou, D; Leligny, H; Pham, C; Labbe, P; Raveau, B BaNiP~2~O~7~, a triclinic diphosphate with a modulated structure ofthe displacive type Acta Crystallographica B (39,1983-), 1991, 47, 608-617 |
| 2106612 | CIF | As2 Nd | P 1 21/c 1 | 4.1081; 6.8201; 10.4431 90; 106.718; 90 | 280.224 | Wang, Y.; Heyding, R.D.; Gabe, E.J.; Calvert, L.D.; Taylor, J.B. Neodymium diarsenide: a single-crysatal structure refinement Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1959-1961 |
| 2103545 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 8.014; 8.014; 5.046 90; 90; 120 | 280.7 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2107130 | CIF | Al0.2 Ba0.68 Fe1.3 H Mn6.5 O16.5 Pb0.3 | I 1 2/m 1 | 10.026; 2.8782; 9.729 90; 91.03; 90 | 280.703 | Post, J.E.; Buseck, P.R.; von Dreele, R.B. Symmetry and Cation Displacements in Hollandites: Structure Refinements of Hollandite, Cryptomelane and Priderite Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1056-1065 |
| 9007648 | CIF | Al0.12 Ba0.34 Fe0.64 Mn3.24 O8 Pb0.08 | I 1 2/m 1 | 10.026; 2.8782; 9.729 90; 91.03; 90 | 280.703 | Post, J. E.; Von Dreele, R. B.; Buseck, P. R. Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: Anisotropic displacement factors from ICSD Acta Crystallographica, Section B, 1982, 38, 1056-1065 |
| 2106604 | CIF | Cl H6 Na O5 | P -1 | 6.96; 8.842; 5.504 92.36; 119.09; 104.73 | 280.768 | Tazzoli, V.; Riganti, V.; Giuseppetti, G.; Coda, A. The crystal structure of sodium chlorite trihydrate, Na Cl O2 (H2 O) Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1032-1037 |
| 2100266 | CIF Paper | O6 Sr2 Ta Y | P 1 21/n 1 | 5.81216; 5.85937; 8.24479 90; 90.1479; 90 | 280.78 | Howard, Christopher J.; Barnes, Paris W.; Kennedy, Brendan J.; Woodward, Patrick M. Structures of the ordered double perovskites Sr~2~YTaO~6~ and Sr~2~YNbO~6~ Acta Crystallographica Section B, 2005, 61, 258-262 |
| 2108166 | CIF | D3 O4 P | P 1 21/c 1 | 5.4357; 4.7148; 10.9698 90; 92.874; 90 | 280.78 | Bull, Craig L.; Funnell, Nicholas P.; Pulham, Colin R.; Marshall, William G.; Allan, David R. A new high-pressure polymorph of phosphoric acid Acta Crystallographica Section B, 2017, 73, 1068-1074 |
| 2100265 | CIF Paper | Nb O6 Sr2 Y | P 1 21/n 1 | 5.81174; 5.86444; 8.24541 90; 90.166; 90 | 281.024 | Howard, Christopher J.; Barnes, Paris W.; Kennedy, Brendan J.; Woodward, Patrick M. Structures of the ordered double perovskites Sr~2~YTaO~6~ and Sr~2~YNbO~6~ Acta Crystallographica Section B, 2005, 61, 258-262 |
| 2103923 | CIF HKL Paper | O8 V4 Y | 9.109; 10.687; 2.887 90; 90; 90 | 281.04 | Onoda, Mitsuko; Dhaussy, Anne-Claire; Kanke, Yasushi Structural characterization of YV~4~O~8~: simultaneous analysis of coexisting polytypes and simulation of diffuse scattering for a stacking disorder model Acta Crystallographica Section B, 2003, 59, 429-438 | |
| 2103543 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 8.022; 8.022; 5.046 90; 90; 120 | 281.2 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2100641 | CIF Paper | F3 Fe | R -3 c :H | 4.919; 4.919; 13.4307 90; 90; 120 | 281.44 | Jørgensen, Jens-Erik; Smith, R. I. On the compression mechanism of FeF~3~ Acta Crystallographica Section B, 2006, 62, 987-992 |
| 2106726 | CIF | Cl H6 Li O7 | P 63 m c | 7.719; 7.719; 5.455 90; 90; 120 | 281.48 | Sequeira, A.; Bernal, I.; Faggiani, R.; Brown, I.D. The structure of lithium perchlorate trihydrate Li (H2 O)3 Cl O4 - an X-ray and neutron diffraction study Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1735-1739 |
| 2103544 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 8.024; 8.024; 5.049 90; 90; 120 | 281.5 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2312498 | CIF | Ge4 N4 O4 Sn | P 63 m c | 5.876; 5.876; 9.418 90; 90; 120 | 281.6 | Gollé-Leidreiter, Philipp; Bhat, Shrikant; Wiehl, Leonore; Wen, Qingbo; Kroll, Peter; Ishikawa, Ryo; Etter, Martin; Farla, Robert; Ikuhara, Yuichi; Riedel, Ralf; Kolb, Ute Crystal structures of two new high-pressure oxynitrides with composition SnGe<sub>4</sub>N<sub>4</sub>O<sub>4</sub>, from single-crystal electron diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 9007677 | CIF | As3 Ni8.499 O16 | R -3 m :R | 9.8105; 9.8105; 9.8105 35.312; 35.312; 35.312 | 281.837 | Fleet, M. E.; Barbier, J. Structure of aerugite (Ni8.5As3O16) and interrelated arsenate and germanate structural series Acta Crystallographica, Section B, 1989, 45, 201-205 |
| 2105024 | CIF HKL Paper | C4 H6 O4 | P 1 21/n 1 | 3.9101; 11.907; 6.221 90; 103.1; 90 | 282.1 | Joseph, Sumy; Sathishkumar, Ranganathan; Mahapatra, Sudarshan; Desiraju, Gautam R. Crystal packing and melting temperatures of small oxalate esters: the role of C—H···O hydrogen bonding Acta Crystallographica Section B, 2011, 67, 525-534 |
| 2022906 | CIF HKL Paper | B3 Ca H7 O9 | P -1 | 6.071; 7.5224; 6.7393 97.606; 107.703; 100.254 | 282.75 | Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite) Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945 |
| 2109072 | CIF HKL | Hf O3 Pb | I m m a | 5.8522; 8.236; 5.867 90; 90; 90 | 282.8 | Bosak, Alexei; Svitlyk, Volodymyr; Arakcheeva, Alla; Burkovsky, Roman; Diadkin, Vadim; Roleder, Krystian; Chernyshov, Dmitry Incommensurate crystal structure of PbHfO~3~ Acta Crystallographica Section B, 2020, 76, 7-12 |
| 2106485 | CIF | H6 Ni O12 S2 | P -1 | 6.751; 6.699; 6.451 94.53; 96.3; 101.28 | 282.869 | Black, W.H.; Griffith, E.A.H.; Robertson, B.E. M S2 O6 (H2 O)6 (M = Mg, Ni, Zn) Acta Crystallographica B (24,1968-38,1982), 1975, 31, 615-617 |
| 2107167 | CIF | S2 Sr | I 4/m c m | 6.095; 6.095; 7.616 90; 90; 90 | 282.927 | Kawada, I.; Kato, K.; Yamaoka, S. Strontium disulphide prepared at high pressure Acta Crystallographica B (24,1968-38,1982), 1976, 32, 3110-3111 |
| 2106865 | CIF | Cl3 Cr Cs | P 63/m m c | 7.257; 7.257; 6.238 90; 90; 120 | 284.505 | Crama, W.J.; Zandbergen, H.W. The jahn-teller effect in the structures of cesium chromium(II) trichloride and cesium chromium(II) triiodide Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1027-1031 |
| 2102652 | CIF Paper | Cr F3 | R -3 c :H | 4.9863; 4.9863; 13.2142 90; 90; 120 | 284.53 | Jοrgensen, J.-E.; Marshall, W.G.; Smith, R.I. The compression mechanism of CrF~3~ Acta Crystallographica Section B, 2004, 60, 669-673 |
| 2103540 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 8.06; 8.06; 5.06 90; 90; 120 | 284.7 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2103542 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 8.063; 8.063; 5.059 90; 90; 120 | 284.8 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 9007616 | CIF | Ca0.017 Fe0.614 Li0.301 Mg0.036 Mn0.333 Na0.014 O4 P0.965 | P m n b | 5.918; 10.037; 4.798 90; 90; 90 | 284.996 | Alberti, A. Crystal structure of ferrisicklerite, Li<1(Fe3+,Mn2+)PO4 Acta Crystallographica, Section B, 1976, 32, 2761-2764 |
| 2103541 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 8.069; 8.069; 5.062 90; 90; 120 | 285.4 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2106663 | CIF | Al4 B2 Co O10 | P 1 21/c 1 | 7.221; 4.371; 9.534 90; 108.45; 90 | 285.454 | Capponi, J.J.; Marezio, M. The high-pressure synthesis and structural refinement of Al4 Co (B O4-582 O2, an anhydrous boron chododite Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2440-2443 |
| 2100015 | CIF | C H2 Cl2 | P b c n | 3.924; 7.793; 9.335 90; 90; 90 | 285.46 | Marcin Podsiad{λ}o; Kamil F. Dziubek; Andrzej Katrusiak In-situ high-pressure crystallization and compression of halogen contacts in dichloromethane Acta Crystallographica, Section B, 2005, 61, 595-600 |
| 2103539 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 8.072; 8.072; 5.065 90; 90; 120 | 285.8 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 9007678 | CIF | Ge3 Mg5.467 Ni4.533 O16 | R -3 m :R | 10.125; 10.125; 10.125 33.79; 33.79; 33.79 | 286.075 | Fleet, M. E.; Barbier, J. Structure of aerugite (Ni8.5As3O16) and interrelated arsenate and germanate structural series Acta Crystallographica, Section B, 1989, 45, 201-205 |
| 2105556 | CIF Paper | Mo3 O8 Zn2 | P 63 m c | 5.77322; 5.77322; 9.91231 90; 90; 120 | 286.116 | Hibble, Simon J.; Cooper, Steven P.; Patat, Saban; Hannon, Alex. C. Total neutron diffraction: a route to the correct local structure of disordered LaMo~2~O~5~ and its application to the model compound Zn~2~Mo~3~O~8~ Acta Crystallographica Section B, 1999, 55, 683-697 |
| 2100653 | CIF Paper | F3 Fe | R -3 c :H | 4.9636; 4.9636; 13.419 90; 90; 120 | 286.32 | Jørgensen, Jens-Erik; Smith, R. I. On the compression mechanism of FeF~3~ Acta Crystallographica Section B, 2006, 62, 987-992 |
| 2106498 | CIF | In P S4 | I -4 | 5.623; 5.623; 9.058 90; 90; 90 | 286.397 | Diehl, R.; Carpentier, C.D. The structural chemistry of indium phosphorous chalkogenides Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1097-1105 |
| 2107165 | CIF | O7 S Te2 | P 21 m n | 4.676; 8.911; 6.879 90; 90; 90 | 286.633 | Loub, J.; Podlahova, J.; Novak, C. Ditellurium(IV) trioxide sulphate Acta Crystallographica B (24,1968-38,1982), 1976, 32, 3115-3116 |
| 2022905 | CIF HKL Paper | B3 Ca H7 O9 | P -1 | 6.095; 7.559; 6.7696 97.576; 107.579; 100.34 | 286.68 | Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite) Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945 |
| 2101235 | CIF Paper | Nb Te4 | P 4/m | 6.4835; 6.4835; 6.8217 90; 90; 90 | 286.76 | Kusz, J.; Böhm, H. The low-temperature structure of NbTe~4~ Acta Crystallographica Section B, 1994, 50, 649-655 |
| 2101236 | CIF Paper | Nb Te4 | P 4/m c c | 6.4835; 6.4835; 6.8217 90; 90; 90 | 286.76 | Kusz, J.; Böhm, H. The low-temperature structure of NbTe~4~ Acta Crystallographica Section B, 1994, 50, 649-655 |
| 2101237 | CIF Paper | Nb Te4 | P 4 | 6.4835; 6.4835; 6.8217 90; 90; 90 | 286.76 | Kusz, J.; Böhm, H. The low-temperature structure of NbTe~4~ Acta Crystallographica Section B, 1994, 50, 649-655 |
| 2105337 | CIF | Ag Ba | P n m a | 8.657; 4.982; 6.651 90; 90; 90 | 286.852 | Merlo, F.; Fornasini, M.L. The structures of alpha-Ca Cu, beta-Ca Cu, Sr Ag and Ba Ag: Four different stacking variants based on noble-metal- centred trigonal prisms Acta Crystallographica B (24,1968-38,1982), 1981, 37, 500-503 |
| 2103538 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 8.084; 8.084; 5.069 90; 90; 120 | 286.9 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2103537 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 8.089; 8.089; 5.064 90; 90; 120 | 287 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2108165 | CIF | D3 O4 P | P 1 21/c 1 | 5.5049; 4.7401; 11.0668 90; 93.355; 90 | 288.28 | Bull, Craig L.; Funnell, Nicholas P.; Pulham, Colin R.; Marshall, William G.; Allan, David R. A new high-pressure polymorph of phosphoric acid Acta Crystallographica Section B, 2017, 73, 1068-1074 |
| 2101172 | CIF Paper | C H6 N2 | P 1 21/c 1 | 10.043; 3.925; 7.67 90; 107.28; 90 | 288.7 | Foulon, M.; Lebrun, N.; Muller, M.; Amazzal, A.; Cohen-Adad, M. T. Structure of the stable phase of methylhydrazine ‒ first observations of phase transitions Acta Crystallographica Section B, 1994, 50, 472-479 |
| 2103536 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 8.105; 8.105; 5.074 90; 90; 120 | 288.7 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2106486 | CIF | H12 O12 S2 Zn | P -1 | 6.799; 6.752; 6.491 94.58; 96.2; 101.47 | 288.748 | Black, W.H.; Griffith, E.A.H.; Robertson, B.E. M S2 O6 (H2 O)6 (M = Mg, Ni, Zn) Acta Crystallographica B (24,1968-38,1982), 1975, 31, 615-617 |
| 2106977 | CIF | H2.5 Na0.5 O3 P | P -3 c 1 | 5.908; 5.908; 9.554 90; 90; 120 | 288.8 | Hazell, R.G.; Hazell, A.C.; Kratochvil, B. Structure of Sodium Hydrogenphosphite Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1267-1269 |
| 2104122 | CIF Paper | Cr2 O3 | R -3 c | 4.958; 4.958; 13.59 90; 90; 120 | 289.3 | Yang, J. Structural analysis of perovskite LaCr~1{-~<i>x</i>}Ni~<i>x~</i>O~3~ by Rietveld refinement of X-ray powder diffraction data Acta Crystallographica Section B, 2008, 64, 281-286 |
| 2106282 | CIF | H3 Na O6 Se2 | P 1 21/n 1 | 10.3428; 4.8372; 5.7876 90; 91.162; 90 | 289.495 | Chomnilpan, S.; Tellgren, R.; Liminga, R. Neutron diffraction refinement of paraelectric Na H3 (Se O3)2 Acta Crystallographica B (24,1968-38,1982), 1977, 33, 2108-2112 |
| 9016385 | CIF | Mg2 O4 Si | P b n m | 4.7534; 10.1902; 5.9783 90; 90; 90 | 289.577 | Fujino, K.; Sasaki, S.; Takeuchi, Y.; Sadanaga, R. X-ray determination of electron distributions in forsterite, fayalite and tephroite Acta Crystallographica, Section B, 1981, 37, 513-518 |
| 1100069 | CIF | H12 Mg O12 S2 | P -1 | 6.819; 6.747; 6.506 94.23; 96.76; 101.72 | 289.6 | Black, W H; Griffith, E A H; Robertson, B E M S~2~ O~6~ (H~2~ O)~6~ (M = Mg, Ni, Zn) Acta Crystallographica B (24,1968-38,1982), 1975, 31, 615-617 |
| 2102010 | CIF Paper | F Nb O2 | R -3 c | 4.9462; 4.9462; 13.6689 90; 90; 120 | 289.61 | Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E. High-pressure transformations of NbO~2~F Acta Crystallographica Section B, 2000, 56, 189-196 |
| 2109083 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.107; 9.206; 6.285 90; 101.08; 90 | 290 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2103534 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 8.116; 8.116; 5.086 90; 90; 120 | 290.1 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 1008752 | CIF | Fe2 Mo3 O8 | P 63 m c | 5.7732; 5.7732; 10.0542 90; 90; 120 | 290.2 | le Page, Y; Strobel, P Structure of Iron(II) Molybdenum(IV) Oxide Fe2 Mo3 O8 Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1265-1267 |
| 2103535 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 8.121; 8.121; 5.084 90; 90; 120 | 290.4 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 9011187 | CIF | Fe Na O8 Ti3 | C 1 2/m 1 | 12.267; 3.823; 6.483 90; 107.16; 90 | 290.497 | Ishiguro, T.; Tanaka, K.; Marumo, F.; Ismail, M. G. M. U.; Hirano, S.; Somiya, S. Freudenbergite Note: anisoU's from ICSD Acta Crystallographica, Section B, 1978, 34, 255-256 |
| 2103533 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 8.126; 8.126; 5.083 90; 90; 120 | 290.7 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 9007507 | CIF | B F4 Na | C m c m | 6.8368; 6.2619; 6.7916 90; 90; 90 | 290.758 | Brunton, G. Refinement of the structure of NaBF4 Acta Crystallographica, Section B, 1968, 24, 1703-1704 |
| 2312435 | CIF HKL | B2 K O6 Sr Y | P 1 21/m 1 | 6.5888; 5.3664; 8.5293 90; 105.389; 90 | 290.77 | Kuznetsov, Artem B.; Kokh, Konstantin A.; Gorelova, Liudmila A.; Sofich, Dmitry O.; Sagatov, Nursultan; Gavryushkin, Pavel N.; Vereshchagin, Oleg S.; Bocharov, Vladimir N.; Shevchenko, Vyacheslav S.; Kokh, Alexander E. Growth, crystal structure and IR luminescence of KSrY<sub>1-x</sub>Er<sub>x</sub>(BO<sub>3</sub>)<sub>2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312437 | CIF HKL | B2 K O6 Sr Y | P 1 21/m 1 | 6.594; 5.3718; 8.5241 90; 105.39; 90 | 291.11 | Kuznetsov, Artem B.; Kokh, Konstantin A.; Gorelova, Liudmila A.; Sofich, Dmitry O.; Sagatov, Nursultan; Gavryushkin, Pavel N.; Vereshchagin, Oleg S.; Bocharov, Vladimir N.; Shevchenko, Vyacheslav S.; Kokh, Alexander E. Growth, crystal structure and IR luminescence of KSrY<sub>1-x</sub>Er<sub>x</sub>(BO<sub>3</sub>)<sub>2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2100638 | CIF Paper | F3 Fe | R -3 c :H | 5.0094; 5.0094; 13.3971 90; 90; 120 | 291.15 | Jørgensen, Jens-Erik; Smith, R. I. On the compression mechanism of FeF~3~ Acta Crystallographica Section B, 2006, 62, 987-992 |
| 2107001 | CIF | Ce4 Ga2 O4 S5 | I 4/m m m | 3.986; 3.986; 18.331 90; 90; 90 | 291.247 | Jaulmes, S.; Godlewski, E.; Palazzi, M.; Etienne, J. Deux Structures Isotypes a Sites Anionique et Cationique Lacunaires: (Ce O)4 Ga2 S5 et (La O)4 As2 S5 Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1707-1710 |
| 2022904 | CIF HKL Paper | B3 Ca H7 O9 | P -1 | 6.124; 7.6014; 6.8051 97.548; 107.416; 100.462 | 291.36 | Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite) Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945 |
| 2100916 | CIF Paper | Fe Li O4 P | P n m a | 10.332; 6.01; 4.692 90; 90; 90 | 291.4 | Streltsov, V. A.; Belokoneva, E. L.; Tsirelson, V. G.; Hansen, N. K. Multipole analysis of the electron density in triphylite, LiFePO~4~, using X-ray diffraction data Acta Crystallographica Section B, 1993, 49, 147-153 |
| 2104742 | CIF Paper | Cu Fe S2 | I -4 2 d | 5.2888; 5.2888; 10.4221 90; 90; 90 | 291.52 | Elliot, Alexander Dean Structure of pyrrhotite 5<i>C</i> (Fe~9~S~10~) Acta Crystallographica Section B, 2010, 66, 271-279 |
| 9007572 | CIF | Cu Fe S2 | I -4 2 d | 5.289; 5.289; 10.423 90; 90; 90 | 291.568 | Hall, S. R.; Stewart, J. M. The crystal structure refinement of chalcopyrite, CuFeS2 Acta Crystallographica, Section B, 1973, 29, 579-585 |
| 2103532 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 8.135; 8.135; 5.09 90; 90; 120 | 291.7 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2108164 | CIF | D3 O4 P | P 1 21/c 1 | 5.5356; 4.7522; 11.1169 90; 93.561; 90 | 291.88 | Bull, Craig L.; Funnell, Nicholas P.; Pulham, Colin R.; Marshall, William G.; Allan, David R. A new high-pressure polymorph of phosphoric acid Acta Crystallographica Section B, 2017, 73, 1068-1074 |
| 2106817 | CIF | C F O3 Tl3 | P 1 1 21/m | 7.51; 7.407; 6.069 90; 90; 120 | 292.368 | Alcock, N.W. The crystal structure of thallous fluoride carbonate Acta Crystallographica B (24,1968-38,1982), 1973, 29, 498-502 |
| 2020661 | CIF | H0.5 K1.5 Mg2 O7 Si2 | P 63/m c m | 5.0535; 5.0535; 13.2229 90; 90; 120 | 292.44 | Welch, M. D.; Bindi, L.; Petříček, V.; Plášil, J. Vacancy pairing and superstructure in the high-pressure silicate K~1.5~Mg~2~Si~2~O~7~H~0.5~: a new potential host for potassium in the deep Earth Acta Crystallographica Section B, 2016, 72, 822-827 |
| 2104757 | CIF Paper | C Fe O3 | R -3 c :H | 4.68653; 4.68653; 15.3832 90; 90; 120 | 292.6 | Elliot, Alexander Dean Structure of pyrrhotite 5<i>C</i> (Fe~9~S~10~) Acta Crystallographica Section B, 2010, 66, 271-279 |
| 2104746 | CIF Paper | C Fe O3 | R -3 c :H | 4.68658; 4.68658; 15.3832 90; 90; 120 | 292.61 | Elliot, Alexander Dean Structure of pyrrhotite 5<i>C</i> (Fe~9~S~10~) Acta Crystallographica Section B, 2010, 66, 271-279 |
| 2022027 | CIF | C6 H18 Cl2 N2 O4 | P 1 | 5.4491; 7.3962; 8.1337 79.382; 73.191; 69.544 | 292.75 | Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76 |
| 2104273 | CIF HKL Paper | C6 H18 Cl2 N2 O4 | P 1 | 5.4491; 7.3962; 8.1337 79.382; 73.191; 69.544 | 292.75 | Dittrich, B.; McKinnon, J. J.; Warren, J. E. Improvement of anisotropic displacement parameters from invariom-model refinements for three <small>L</small>-hydroxylysine structures Acta Crystallographica Section B, 2008, 64, 750-759 |
| 2100014 | CIF | C H2 Cl2 | P b c n | 3.984; 7.863; 9.357 90; 90; 90 | 293.12 | Marcin Podsiad{λ}o; Kamil F. Dziubek; Andrzej Katrusiak In-situ high-pressure crystallization and compression of halogen contacts in dichloromethane Acta Crystallographica, Section B, 2005, 61, 595-600 |
| 2103530 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 8.155; 8.155; 5.091 90; 90; 120 | 293.2 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 9007517 | CIF | As Cu3 S4 | P m n 21 | 7.407; 6.436; 6.154 90; 90; 90 | 293.37 | Adiwidjaja, G.; Lohn, J. Strukturverfeinerung von enargit, Cu3AsS4 Acta Crystallographica, Section B, 1970, 26, 1878-1879 |
| 2108841 | CIF HKL Paper | H8 Mg O8 Te | I 4/m m m (a+b,-a+b,c) | 5.3282; 5.3282; 10.3363 90; 90; 90 | 293.445 | Stöger, Berthold; Krüger, Hannes; Weil, Matthias Mg(H~2~O)~2~[TeO~2~(OH)~4~]: a polytypic structure with a two-mode disordered stacking arrangement Acta Crystallographica Section B, 2021, 77 |
| 2103531 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 8.158; 8.158; 5.099 90; 90; 120 | 293.9 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2102997 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2894; 10.547; 5.2697 90; 90; 90 | 293.98 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2104228 | CIF Paper | Co2 O4 Si | P n m a | 10.2864; 5.9872; 4.7785 90; 90; 90 | 294.292 | Sazonov, Andrew; Meven, Martin; Hutanu, Vladimir; Kaiser, Volker; Heger, Gernot; Trots, Dmytro; Merz, Michael Structural behaviour of synthetic Co~2~SiO~4~ at low temperatures Acta Crystallographica Section B, 2008, 64, 661-668 |
| 2106721 | CIF | H4 N2 O8 Zn | P 1 21/c 1 | 5.754; 5.978; 8.557 90; 91; 90 | 294.294 | Petrovic, D.; Ribar, B. A redertimination of the crystal structure of Zn (N O3) (H2 O)2 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1795-1796 |
| 2102998 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2918; 10.55; 5.2717 90; 90; 90 | 294.31 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2106497 | CIF | H3 N O4 | P 21 c n | 5.4647; 8.6439; 6.2308 90; 90; 90 | 294.32 | Delaplane, R.G.; Taesler, I.; Olovsson, I. Hydrogen bond studies. XCIII. Oxonium ion in nitric acid monohydrate Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1486-1489 |
| 2102996 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2909; 10.544; 5.2763 90; 90; 90 | 294.35 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2104227 | CIF Paper | Co2 O4 Si | P n m a | 10.2869; 5.9889; 4.7781 90; 90; 90 | 294.365 | Sazonov, Andrew; Meven, Martin; Hutanu, Vladimir; Kaiser, Volker; Heger, Gernot; Trots, Dmytro; Merz, Michael Structural behaviour of synthetic Co~2~SiO~4~ at low temperatures Acta Crystallographica Section B, 2008, 64, 661-668 |
| 2103529 | CIF | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 8.167; 8.167; 5.098 90; 90; 120 | 294.5 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2102058 | CIF Paper | Br2 H6 N2 Pd | P -1 | 6.7854; 7.1057; 6.6241 103.221; 102.514; 100.386 | 294.52 | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S. Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state Acta Crystallographica, Section B: Structural Science, 2000, 56, 419-425 |
| 2102995 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2914; 10.539; 5.2828 90; 90; 90 | 294.6 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2102118 | CIF Paper | O7 P2 Zr | P n n m | 8.3127; 6.6389; 5.3407 90; 90; 90 | 294.74 | Krogh Andersen, Anne Marie; Norby, Poul <i>Ab initio</i> structure determination and Rietveld refinement of a high-temperature phase of zirconium hydrogen phosphate and a new polymorph of zirconium pyrophosphate from <i>in situ</i> temperature-resolved powder diffraction data Acta Crystallographica Section B, 2000, 56, 618-625 |
| 2102994 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2923; 10.539; 5.2864 90; 90; 90 | 294.85 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2107124 | CIF | S2 Si | I b a m | 9.545; 5.564; 5.552 90; 90; 90 | 294.858 | Peters, J.; Krebs, B. Silicon disulphide and silicon diselenide: A reinvestigation Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1270-1272 |
| 2102993 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2934; 10.537; 5.2889 90; 90; 90 | 295 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2101643 | CIF Paper | C8 H10 Fe O12 | P -1 | 5.1577; 7.4107; 8.7823 66.846; 77.109; 74.748 | 295.05 | Lee, Chi-Rung; Wang, Chih-Chieh; Wang, Yu Structural relationship of various squarates Acta Crystallographica Section B, 1996, 52, 966-975 |
| 2311721 | CIF | C4 H12 Cl4 Fe N | P 1 m 1 | 6.425; 7.148; 6.4274 90; 91.21; 90 | 295.12 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2107171 | CIF | Ho Zn3 | P n m a | 6.697; 4.3655; 10.099 90; 90; 90 | 295.252 | Michel, D.J.; Ryba, E. The crystal structure of Ho Zn3 Acta Crystallographica B (24,1968-38,1982), 1968, 24, 1267-1269 |
| 2105802 | CIF HKL Paper | K Lu S2 | R -3 m :H | 3.949; 3.949; 21.871 90; 90; 120 | 295.37 | Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series Acta Crystallographica Section B, 2014, 70, 360-371 |
| 2102992 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2954; 10.534; 5.2952 90; 90; 90 | 295.38 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2107356 | CIF | B2 H16 Na2 O14 | P -1 | 6.837; 7.37; 7.283 98.77; 101.85; 120.33 | 295.405 | Carrondo, M.A.A.F.de.C.T.; Skapski, A.C. Refinement of the X-ray Crystal Structure of the Industrial Bleaching Agent Disodium Tetrahydroxo-di-mue-peroxo-diborate Hexahydrate, Na2 (B2 (O2)2 (O H)4 ) * (H2 O)6 Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3551-3554 |
| 2104226 | CIF Paper | Co2 O4 Si | P n m a | 10.3005; 6.0028; 4.7816 90; 90; 90 | 295.655 | Sazonov, Andrew; Meven, Martin; Hutanu, Vladimir; Kaiser, Volker; Heger, Gernot; Trots, Dmytro; Merz, Michael Structural behaviour of synthetic Co~2~SiO~4~ at low temperatures Acta Crystallographica Section B, 2008, 64, 661-668 |
| 2102991 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2959; 10.534; 5.3014 90; 90; 90 | 295.75 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2108163 | CIF | D3 O4 P | P 1 21/c 1 | 5.5686; 4.7647; 11.1762 90; 93.81; 90 | 295.88 | Bull, Craig L.; Funnell, Nicholas P.; Pulham, Colin R.; Marshall, William G.; Allan, David R. A new high-pressure polymorph of phosphoric acid Acta Crystallographica Section B, 2017, 73, 1068-1074 |
| 2105031 | CIF HKL Paper | C10 H18 O4 | P -1 | 4.593; 4.702; 14.03 95.896; 97.964; 96.656 | 295.9 | Joseph, Sumy; Sathishkumar, Ranganathan; Mahapatra, Sudarshan; Desiraju, Gautam R. Crystal packing and melting temperatures of small oxalate esters: the role of C—H···O hydrogen bonding Acta Crystallographica Section B, 2011, 67, 525-534 |
| 2102990 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2956; 10.532; 5.3055 90; 90; 90 | 295.91 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2106178 | CIF | C2 H6 N4 O4 Zn | P 1 c 1 | 6.87; 5.08; 9.1 90; 111.2; 90 | 296.093 | Bigoli, F.; Braibanti, A.; Tiripicchio, A.; Tiripicchio Camellini, M. Structures of Chelates of Hydrazinecaboxylic Acid. Bis(hydrazinecarboxylato-N,O)-zinc Acta Crystallographica B (24,1968-38,1982), 1971, 27, 2453-2457 |
| 2102989 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2968; 10.53; 5.3089 90; 90; 90 | 296.11 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2102988 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2979; 10.529; 5.3139 90; 90; 90 | 296.42 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2106158 | CIF | Dy Zn3 | P n m a | 6.7; 4.398; 10.06 90; 90; 90 | 296.434 | Michel, D.J.; Ryba, E. The crystal structure of Ho Zn3 Acta Crystallographica B (24,1968-38,1982), 1968, 24, 1267-1269 |
| 2106590 | CIF | Al1.1 Ba0.98 Ca0.03 Ni0.48 O16 Ti6.4 Zr0.02 | I 4/m | 10.039; 10.039; 2.943 90; 90; 90 | 296.6 | Sinclair, W.; McLaughlin, G.M.; Ringwood, A.E. The Structure and Chemistry of a Barium Titanate Hollandite-Type Phase Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2913-2918 |
| 2102987 | CIF Paper | O7 Sr V3 | P m m n :2 | 5.2988; 10.527; 5.3183 90; 90; 90 | 296.66 | Prinz, Sebastian; Sparta, Karine M.; Roth, Georg Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure Acta Crystallographica Section B, 2007, 63, 836-842 |
| 2103523 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 8.188; 8.188; 5.113 90; 90; 120 | 296.9 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2021895 | CIF | O5 Rb2 Ti2 | C 1 2/m 1 | 11.3457; 3.8195; 6.9699 90; 100.359; 90 | 297.12 | Federicci, Rémi; Baptiste, Benoit; Finocchi, Fabio; Popa, Florin; Brohan, Luc; Béneut, Keevin; Giura, Paola; Rousse, Gwenaëlle; Descamps-Mandine, Armel; Douillard, Thierry; Shukla, Abhay; Leridon, Brigitte The crystal structure of Rb2Ti2O5 Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1142 |
| 9007625 | CIF | O4 Si Th | P 1 21/n 1 | 6.784; 6.974; 6.5 90; 104.92; 90 | 297.158 | Taylor, M.; Ewing, R. C. The crystal structure of the ThSiO4 polymorphs: huttonite and thorite Acta Crystallographica, Section B, 1978, 34, 1074-1079 |
| 2017773 | CIF HKL Paper | Ga5.34 La3 O14 Si0.36 Ta0.29 | P 3 2 1 | 8.195; 8.195; 5.118 90; 90; 120 | 297.7 | Chitra, R.; Choudhury, R. R. Single-crystal neutron diffraction investigation on crystals belonging to the langasite family: a comparative study Acta Crystallographica Section B, 2010, 66, 497-502 |
| 2311728 | CIF | C4 H12 Cl4 Ga N | P 1 m 1 | 6.4571; 7.1456; 6.4596 90; 91.721; 90 | 297.91 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2106397 | CIF | Y Zn3 | P n m a | 6.69; 4.405; 10.111 90; 90; 90 | 297.966 | Michel, D.C.; Ryba, E. The crystal structure of Ho Zn3 Acta Crystallographica B (24,1968-38,1982), 1968, 24, 1267-1269 |
| 2021896 | CIF | O5 Rb2 Ti2 | C 1 2/m 1 | 11.337; 3.8244; 6.9946 90; 100.308; 90 | 298.37 | Federicci, Rémi; Baptiste, Benoit; Finocchi, Fabio; Popa, Florin; Brohan, Luc; Béneut, Keevin; Giura, Paola; Rousse, Gwenaëlle; Descamps-Mandine, Armel; Douillard, Thierry; Shukla, Abhay; Leridon, Brigitte The crystal structure of Rb2Ti2O5 Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1142 |
| 2108901 | CIF HKL | C4 H11 Na2 O14 Rh | P -1 | 5.55; 6.44; 8.59 94.2; 99.4; 98.1 | 298.42 | Garkul, Ilia; Zadesenets, Andrey; Filatov, Evgeny; Baidina, Iraida; Tkachev, Sergey; Samsonenko, Denis; Korenev, Sergey Oxonium <i>trans</i>-bis(oxalato)rhodate and related sodium salts: a rare example of crystalline complex acid Acta Crystallographica Section B, 2021, 77, 1048-1054 |
| 2103502 | CIF | Ga5.5 La3 Nb0.5 O14 | P 3 2 1 | 8.202; 8.202; 5.123 90; 90; 120 | 298.5 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 5910115 | CIF Paper | C2 H6 O | P 1 c 1 | 5.377; 6.882; 8.255 90; 102.2; 90 | 298.6 | P.-G. Jönsson Hydrogen bond studies. CXIII. The crystal structure of ethanol at 87 K Acta Crystallogr.,Sect.B:Struct.Crystallogr.Cryst.Chem., 1976, 32, 232-235 |
| 2108156 | CIF HKL | Cu3 H4 O8 Te | C m c m | 2.93172; 11.8414; 8.6047 90; 90; 90 | 298.72 | Missen, O. P.; Mills, S. J.; Welch, M. D.; Spratt, J.; Rumsey, M. S.; Birch, W. D.; Brugger, J. The crystal structure of cesbronite, Cu~3~TeO~4~(OH)~4~: a novel sheet tellurate topology Acta Crystallographica Section B, 2018, 74, 24-31 |
| 2103501 | CIF Paper | Ga5.54 La3 O14 Ta0.46 | P 3 2 1 | 8.213; 8.213; 5.115 90; 90; 120 | 298.8 | Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B, 2002, 58, 939-947 |
| 2021897 | CIF | O5 Rb2 Ti2 | C 1 2/m 1 | 11.3419; 3.8198; 7.0103 90; 100.298; 90 | 298.82 | Federicci, Rémi; Baptiste, Benoit; Finocchi, Fabio; Popa, Florin; Brohan, Luc; Béneut, Keevin; Giura, Paola; Rousse, Gwenaëlle; Descamps-Mandine, Armel; Douillard, Thierry; Shukla, Abhay; Leridon, Brigitte The crystal structure of Rb2Ti2O5 Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1142 |
| 2107103 | CIF | B H Na2 O3 | P n m a | 8.627; 3.512; 9.863 90; 90; 90 | 298.829 | Menchetti, S.; Sabelli, C. Structure of Hydrated Sodium Borate Na2 (B O2 (O H)) Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1282-1285 |
| 1008168 | CIF | Ag2 H O4 P | P 31 1 2 | 6.19; 6.19; 9.015 90; 90; 120 | 299.1 | Tordjman, I; Boudjada, A; Guitel, J C; Masse, R Structure de l'Hydrogenophosphate D'Argent Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3723-3725 |
| 2101361 | CIF Paper | C5 H12 O4 | I -4 | 6.0173; 6.0173; 8.267 90; 90; 90 | 299.33 | Katrusiak, A. High-pressure X-ray diffraction study of pentaerythritol Acta Crystallographica Section B, 1995, 51, 873-879 |
| 2100347 | CIF Paper | C3 H9 Cl Si | P m n 21 | 7.668; 6.34; 6.159 90; 90; 90 | 299.4 | Roman Gajda; Kamil F. Dziubek; Andrzej Katrusiak Absence of halogen···halogen interactions in chlorotrimethylsilane polymorphs Acta Crystallographica Section B, 2006, 62, 86-93 |
| 2106583 | CIF | O3 V2 | R -3 c :H | 4.9776; 4.9776; 13.9647 90; 90; 120 | 299.642 | Robinson, W.R. High-temperature crystal chemistry of V2 O3 and 1% chromium- doped V2 O3 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1153-1160 |
| 2101560 | CIF Paper | Bi2 Rh | P -1 | 6.743; 7.03; 7.067 104.76; 100.73; 105.79 | 299.74 | Ruck, M. Kristallstruktur und zwillingsbildung der intermetallischen phase β-Bi~2~Rh Acta Crystallographica Section B, 1996, 52, 605-609 |
| 2106826 | CIF | Ca2 Mn3 O8 | C 1 2/m 1 | 11.014; 5.851; 4.942 90; 109.73; 90 | 299.78 | Ansell, G.B.; Horowitz, H.S.; Modrick, M.A.; Longo, J.M.; Poeppelmeier, K.R. Structure of Calcium Manganese Oxide Ca2 Mn3 O8 Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1795-1797 |
| 2106749 | CIF | C N Na S | P m c n | 4.035; 5.601; 13.276 90; 90; 90 | 300.038 | Bats, J.W.; Coppens, P.; Kvick, A. The experimental charge distribution in sulfur-containing molecules. Structure determination and electron density study of Na S C N at reduced temperatures Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1534-1542 |
| 2106067 | CIF | H2 O4 U | C m c a | 4.242; 10.302; 6.868 90; 90; 90 | 300.139 | Taylor, J.C. The structure of the alpha form of uranyl hydroxide Acta Crystallographica B (24,1968-38,1982), 1971, 27, 1088-1091 |
| 2017772 | CIF HKL Paper | Ga5.61 La3 O14 Ta0.41 | P 3 2 1 | 8.224; 8.224; 5.126 90; 90; 120 | 300.2 | Chitra, R.; Choudhury, R. R. Single-crystal neutron diffraction investigation on crystals belonging to the langasite family: a comparative study Acta Crystallographica Section B, 2010, 66, 497-502 |
| 9011260 | CIF | Mg2 O4 Ti | P 41 2 2 | 5.9748; 5.9748; 8.414 90; 90; 90 | 300.365 | Wechsler, B. A.; Von Dreele, R. B. Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 773 K Acta Crystallographica, Section B, 1989, 45, 542-549 |
| 9011135 | CIF | As Lu O4 | I 41/a m d :2 | 6.949; 6.949; 6.227 90; 90; 90 | 300.693 | Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C. Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic Note: isostructural with Chernovite-(Y) Acta Crystallographica, Section B, 1973, 29, 141-142 |
| 2003036 | CIF Paper | C4 H9 N O4 | P -1 | 7.46; 8.805; 4.6768 91.84; 92.73; 101.2 | 300.74 | Kashino, Setsuo; Taka, Jun-ichiro; Yoshida, Tadanori; Kubozono, Yoshihiro; Ishida, Hiroyuki; Maeda, Hironobu Structure of Ammonium Hydrogen Succinate at 80 and 20 K Acta Crystallographica Section B, 1998, 54, 889-894 |
| 9016039 | CIF | C H K O3 | P 1 21/a 1 | 15.115; 5.6044; 3.6609 90; 103.98; 90 | 300.931 | Thomas, J. O.; Tellgren, R.; Olovsson, I. Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 95 K Note z-coordinate of O3 has been modified with a negative sign Acta Crystallographica, Section B, 1974, 30, 1155-1166 |
| 2003035 | CIF Paper | C4 H9 N O4 | P -1 | 7.456; 8.813; 4.6806 91.74; 92.85; 101.11 | 301.17 | Kashino, Setsuo; Taka, Jun-ichiro; Yoshida, Tadanori; Kubozono, Yoshihiro; Ishida, Hiroyuki; Maeda, Hironobu Structure of Ammonium Hydrogen Succinate at 80 and 20 K Acta Crystallographica Section B, 1998, 54, 889-894 |
| 2106584 | CIF | Cr0.02 O3 V1.98 | R -3 c :H | 4.9974; 4.9974; 13.926 90; 90; 120 | 301.193 | Robinson, W.R. High-temperature crystal chemistry of V2 O3 and 1% chromium-doped V2 O3 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1153-1160 |
| 2101467 | CIF Paper | C4 H9 N O4 | P -1 | 7.4384; 8.8222; 4.6875 91.48; 93.178; 100.85 | 301.44 | Hirano, A.; Kubozono, Y.; Maeda, H.; Ishida, H.; Kashino, S. Structure of ammonium hydrogen succinate above and below the phase transition around 170K Acta Crystallographica Section B, 1996, 52, 323-327 |
| 2106902 | CIF | Ca H4 O8 P2 | P -1 | 7.5577; 8.2531; 5.5504 109.87; 93.68; 109.15 | 301.502 | Dickens, B.; Prince, E.; Schroeder, L.W.; Brown, W.E. Ca (H2 P O4)2, a crystal structure containing unusual hydrogen bonding Acta Crystallographica B (24,1968-38,1982), 1973, 29, 2057-2070 |
| 9016501 | CIF | C D K O3 | P 1 21/a 1 | 15.1311; 5.6054; 3.6644 90; 103.953; 90 | 301.629 | Thomas, J. O.; Tellgren, R.; Olovsson, I. Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 95 K Acta Crystallographica, Section B, 1974, 30, 1155-1166 |
| 2106225 | CIF | Br Na O3 | P 21 3 | 6.70717; 6.70717; 6.70717 90; 90; 90 | 301.73 | Abrahams, S.C.; Bernstein, J.L. Remeasurement of optically active NaClO3 and NaBrO3 Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3601-3604 |
| 2101167 | CIF Paper | Fe2 O3 | R -3 c :H | 5.0355; 5.0355; 13.7471 90; 90; 120 | 301.88 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N. Synchrotron X-ray study of the electron density in α-Fe~2~O~3~ Acta Crystallographica Section B, 1994, 50, 435-441 |
| 2101168 | CIF Paper | Fe2 O3 | R -3 c :H | 5.0355; 5.0355; 13.7471 90; 90; 120 | 301.88 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N. Synchrotron X-ray study of the electron density in α-Fe~2~O~3~ Acta Crystallographica Section B, 1994, 50, 435-441 |
| 2101169 | CIF Paper | Fe2 O3 | R -3 c :H | 5.0355; 5.0355; 13.7471 90; 90; 120 | 301.88 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N. Synchrotron X-ray study of the electron density in α-Fe~2~O~3~ Acta Crystallographica Section B, 1994, 50, 435-441 |
| 2312082 | CIF HKL Paper | As4 Cl2 H10 N2 O7 | P 6/m m m | 5.2542; 5.2542; 12.6308 90; 90; 120 | 301.978 | Wrześniewska, Weronika; Paluch, Piotr; Guńka, Piotr A Arsenic(III) oxide intercalate with ammonium chloride: crystal structure revision and thermal characterization. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 207-212 |
| 2101516 | CIF Paper | Co Na O4 P | P n m a | 8.871; 6.78; 5.023 90; 90; 90 | 302.11 | Hammond, R.; Barbier, J. Structural chemistry of NaCoPO~4~ Acta Crystallographica Section B, 1996, 52, 440-449 |
| 2107002 | CIF | As2 La4 O4 S5 | I 4/m m m | 4.092; 4.092; 18.046 90; 90; 90 | 302.171 | Jaulmes, S.; Palazzi, M.; Godlewski, E.; Etienne, J. Deux Structures Isotypes a Sites Anionique et Cationique Lacunaires: (Ce O)4 Ga2 S5 et (La O)4 As2 S5 Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1707-1710 |
| 2101466 | CIF Paper | C4 H9 N O4 | P -1 | 7.437; 8.834; 4.6927 91.32; 93.37; 100.68 | 302.26 | Hirano, A.; Kubozono, Y.; Maeda, H.; Ishida, H.; Kashino, S. Structure of ammonium hydrogen succinate above and below the phase transition around 170K Acta Crystallographica Section B, 1996, 52, 323-327 |
| 2100650 | CIF Paper | F3 Fe | R -3 c :H | 5.1145; 5.1145; 13.347 90; 90; 120 | 302.36 | Jørgensen, Jens-Erik; Smith, R. I. On the compression mechanism of FeF~3~ Acta Crystallographica Section B, 2006, 62, 987-992 |
| 1007030 | CIF | Ag2 Cr2 O7 | P -1 | 6.968; 7.148; 6.544 110.82; 96.11; 91.05 | 302.4 | Durif, A; Averbuch-Pouchot, M T Structure du dichromate d'argent: Ag~2~ Cr~2~ O~7~ Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3335-3337 |
| 2106758 | CIF | Al9 Fe Mg3 Si5 | P -6 2 m | 6.64; 6.64; 7.92 90; 90; 120 | 302.407 | Foss, S.; Olsen, A.; Simensen, C.J.; Tafto, J. Determination of the crystal structure of the pi-(Al Fe Mg Si) phase using symmetry- and site-sensitive electron microscope techniques Acta Crystallographica B (39,1983-), 2003, 59, 36-42 |
| 2105299 | CIF Paper | C2 H4 K O6 P | P 1 21 1 | 7.842; 4.577; 8.56 90; 100.04; 90 | 302.5 | Mermer, Adrian; Starynowicz, Przemysław Charge-density distribution in potassium dihydrogen phosphoglycolate ‒ a comparison of phosphate and phosphonate groups Acta Crystallographica Section B, 2012, 68, 625-635 |
| 2109082 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.173; 9.3305; 6.3822 90; 100.777; 90 | 302.61 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2101642 | CIF Paper | C8 H10 Mn O12 | P -1 | 5.194; 7.454; 8.9007 67.07; 77.26; 74.46 | 303.1 | Lee, Chi-Rung; Wang, Chih-Chieh; Wang, Yu Structural relationship of various squarates Acta Crystallographica Section B, 1996, 52, 966-975 |
| 2107229 | CIF | Ba1.33 Mg1.33 O16 Ti6.67 | I 1 2/m 1 | 10.2609; 2.98052; 9.9212 90; 91.072; 90 | 303.365 | Cheary, R.W.; Squadrito, R. A structural analysis of barium magnesium hollandites Acta Crystallographica B (39,1983-), 1989, 45, 205-212 |
| 2017774 | CIF HKL Paper | Ga5.48 La3 O14 Ta0.03 Zr0.5 | P 3 2 1 | 8.256; 8.256; 5.141 90; 90; 120 | 303.5 | Chitra, R.; Choudhury, R. R. Single-crystal neutron diffraction investigation on crystals belonging to the langasite family: a comparative study Acta Crystallographica Section B, 2010, 66, 497-502 |
| 2107227 | CIF | Ba1.14 Mg1.14 O16 Ti6.86 | I 1 2/m 1 | 10.1816; 2.9733; 10.0268 90; 90.489; 90 | 303.53 | Cheary, R.W.; Squadrito, R. A structural analysis of barium magnesium hollandites Acta Crystallographica B (39,1983-), 1989, 45, 205-212 |
| 1008948 | CIF | Ba1.2 Mg1.2 O16 Ti6.8 | I 1 2/m 1 | 10.227; 2.981; 9.964 90; 90.77; 90 | 303.7 | Fanchon, E; Vicat, J; Hodeau, J L; Wolfers, P; Duc Tran Qui; Strobel, P Commensurate ordering and domains in the Ba1.2 Ti6.8 Mg1.2 O16 hollandite. Acta Crystallographica B (39,1983-), 1987, 43, 440-448 |
| 2101942 | CIF Paper | Cl5 Mo | P -1 | 6.716; 9.048; 6.074 89.19; 118.17; 108.85 | 303.7 | Beck, J.; Wolf, F. Three New Polymorphic Forms of Molybdenum Pentachloride Acta Crystallographica Section B, 1997, 53, 895-903 |
| 2100606 | CIF HKL Paper | C10 H8 | P 1 21/a 1 | 7.6778; 5.721; 8.395 90; 124.55; 90 | 303.71 | F. P. A. Fabbiani; D. R. Allan; S. Parsons; C. R. Pulham Exploration of the high-pressure behaviour of polycyclic aromatic hydrocarbons: naphthalene, phenanthrene and pyrene Acta Crystallographica Section B, 2006, 62, 826-842 |
| 9016304 | CIF | C H K O3 | P 1 21/a 1 | 15.1538; 5.6186; 3.6868 90; 104.356; 90 | 304.104 | Thomas, J. O.; Tellgren, R.; Olovsson, I. Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 219 K Acta Crystallographica, Section B, 1974, 30, 1155-1166 |
| 2108162 | CIF | D3 O4 P | P 1 21/c 1 | 5.6334; 4.78996; 11.3055 90; 94.255; 90 | 304.22 | Bull, Craig L.; Funnell, Nicholas P.; Pulham, Colin R.; Marshall, William G.; Allan, David R. A new high-pressure polymorph of phosphoric acid Acta Crystallographica Section B, 2017, 73, 1068-1074 |
| 9014844 | CIF | C D K O3 | P 1 21/a 1 | 15.17; 5.6183; 3.6885 90; 104.297; 90 | 304.633 | Thomas, J. O.; Tellgren, R.; Olovsson, I. Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 219 K Acta Crystallographica, Section B, 1974, 30, 1155-1166 |
| 9007646 | CIF | Ba0.1 Fe0.52 K0.66 Mg0.12 Na0.02 O8 Ti3.36 | I 4/m | 10.139; 10.139; 2.9664 90; 90; 90 | 304.944 | Post, J. E.; Von Dreele, R. B.; Buseck, P. R. Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: Anisotropic displacement factors from ICSD Acta Crystallographica, Section B, 1982, 38, 1056-1065 |
| 9017297 | CIF | Ca O4 S | B m m b | 6.992; 6.999; 6.24 90; 90; 90 | 305.367 | Morikawa, H.; Tomita, T.; Minato, I.; Iwai, S. Anhydrite: a refinement Acta Crystallographica, Section B, 1975, 31, 2164-2165 |
| 2101046 | CIF Paper | K0 O16 Ti8 | I 4/m | 10.164; 10.164; 2.9631 90; 90; 90 | 306.11 | Sasaki, T.; Watanabe, M.; Fujiki, Y. Structure of K~1.0~Ti~8~O~16~ and K~0.0~Ti~8~O~16~ Acta Crystallographica Section B, 1993, 49, 838-841 |
| 9017312 | CIF | Ca O4 S | A m m a | 7.006; 6.998; 6.245 90; 90; 90 | 306.18 | Kirfel, A.; Will, G. Charge density in anhydrite, CaSO4, from X-ray and neutron diffraction measurements Acta Crystallographica, Section B, 1980, 36, 2881-2890 |
| 2106105 | CIF | Gd2 Pt | P n m a | 7.186; 4.813; 8.854 90; 90; 90 | 306.226 | le Roy, J.; Moreau, J.M.; Paccard, D.; Parthe, E. Structures of the rare-earth-platinum compounds R7 Pt3, R2 Pt, R5 Pt3 and R Pt Acta Crystallographica B (24,1968-38,1982), 1978, 34, 9-13 |
| 2103590 | CIF HKL Paper | Mo2 O8 Zr | C 1 2/m 1 | 9.7643; 5.99021; 5.24841 90; 93.14; 90 | 306.52 | Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B, 2001, 57, 20-26 |
| 2105803 | CIF HKL Paper | K S2 Y | R -3 m :H | 4.0216; 4.0216; 21.884 90; 90; 120 | 306.52 | Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series Acta Crystallographica Section B, 2014, 70, 360-371 |
| 2102863 | CIF Paper | K1.56 Mg0.78 O16 Ti7.22 | I 4/m | 10.1541; 10.1541; 2.9735 90; 90; 90 | 306.58 | Michiue, Yuichi Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb) Acta Crystallographica, Section B, 2007, 63, 577-583 |
| 2102864 | CIF Paper | K1.55 Mg0.77 O16 Ti7.23 | I 4/m | 10.1541; 10.1541; 2.9735 90; 90; 90 | 306.58 | Michiue, Yuichi Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb) Acta Crystallographica, Section B, 2007, 63, 577-583 |
| 2102865 | CIF Paper | K1.53 Mg0.77 O16 Ti7.23 | I 4/m | 10.1541; 10.1541; 2.9735 90; 90; 90 | 306.58 | Michiue, Yuichi Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb) Acta Crystallographica, Section B, 2007, 63, 577-583 |
| 2102866 | CIF Paper | K1.54 Mg0.77 O16 Ti7.23 | I 4/m | 10.1541; 10.1541; 2.9735 90; 90; 90 | 306.58 | Michiue, Yuichi Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb) Acta Crystallographica, Section B, 2007, 63, 577-583 |
| 2103836 | CIF HKL Paper | C14 H12 N2 O4 | P -1 | 3.804; 8.8743; 9.8764 109.757; 97.246; 96.813 | 306.6 | Bowes, Katharine F.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Salts of maleic and fumaric acids with organic polyamines: comparison of isomeric acids as building blocks in supramolecular chemistry Acta Crystallographica Section B, 2003, 59, 100-117 |
| 9014545 | CIF | C H K O3 | P 1 21/a 1 | 15.1725; 5.6283; 3.711 90; 104.631; 90 | 306.626 | Thomas, J. O.; Tellgren, R.; Olovsson, I. Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 298 K Acta Crystallographica, Section B, 1974, 30, 1155-1166 |
| 2102967 | CIF HKL Paper | C H2 Br Cl | P b c n | 3.9929; 7.9351; 9.6808 90; 90; 90 | 306.73 | Podsiadło, Marcin; Katrusiak, Andrzej Isobaric and isochoric freezing of CH~2~BrCl and isostructural relations between CH~2~Cl~2~, CH~2~Br~2~ and CH~2~BrCl Acta Crystallographica Section B, 2007, 63, 903-911 |
| 2101045 | CIF Paper | K O16 Ti8 | I 4/m | 10.1776; 10.1776; 2.9614 90; 90; 90 | 306.75 | Sasaki, T.; Watanabe, M.; Fujiki, Y. Structure of K~1.0~Ti~8~O~16~ and K~0.0~Ti~8~O~16~ Acta Crystallographica Section B, 1993, 49, 838-841 |
| 2105465 | CIF Paper | C5 H12 N2 | P 1 21 1 | 5.213; 8.471; 7.2048 90; 105.362; 90 | 306.79 | Reibenspies, Joseph; Bhuvanesh, Nattamai Absolute structure of <i>R</i>-({-})-2-methylpiperazine and <i>S</i>-(+)-2-methylpiperazine Acta Crystallographica Section B, 2013, 69, 288-293 |
| 2106084 | CIF | Ca H O4 P | P -1 | 6.916; 6.619; 6.946 96.18; 103.82; 88.34 | 306.966 | Catti, M.; Ferraris, G.; Mason, S.A. Low-temperature ordering of hydrogen atoms in Ca H P O4 (Monetite): X-ray and neutron diffraction study at 145K Acta Crystallographica B (24,1968-38,1982), 1980, 36, 254-259 |
| 2105466 | CIF HKL Paper | C5 H12 N2 | P 1 21 1 | 5.209; 8.4798; 7.2037 90; 105.254; 90 | 306.99 | Reibenspies, Joseph; Bhuvanesh, Nattamai Absolute structure of <i>R</i>-({-})-2-methylpiperazine and <i>S</i>-(+)-2-methylpiperazine Acta Crystallographica Section B, 2013, 69, 288-293 |
| 9014660 | CIF | C D K O3 | P 1 21/a 1 | 15.1948; 5.6307; 3.7107 90; 104.567; 90 | 307.272 | Thomas, J. O.; Tellgren, R.; Olovsson, I. Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 298 K Acta Crystallographica, Section B, 1974, 30, 1155-1166 |
| 1000064 | CIF | Fe2 O4 Si | P b n m | 4.8195; 10.4788; 6.0873 90; 90; 90 | 307.4 | Fujino, K.; Sasaki, S.; Takeuchi, Y.; Sadanaga, R. X-ray Determination of Electron Distributions in Forsterite, Fayalite and Tephroite Acta Crystallographica B (24,1968-38,1982), 1981, 37, 513-518 |
| 9011261 | CIF | Mg O3 Ti | R -3 :H | 5.05478; 5.05478; 13.8992 90; 90; 120 | 307.557 | Wechsler, B. A.; Von Dreele, R. B. Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Acta Crystallographica, Section B, 1989, 45, 542-549 |
| 2104156 | CIF Paper | D4 Sn | C 1 2/c 1 | 8.87431; 4.54743; 8.75705 90; 119.288; 90 | 308.219 | Maley, Iain J.; Brown, Daniel H.; Ibberson, Richard M.; Pulham, Colin R. Solid-state structures of the covalent hydrides germane and stannane Acta Crystallographica Section B, 2008, 64, 312-317 |
| 2103589 | CIF HKL Paper | Mo2 O8 Zr | C 1 2/m 1 | 9.7834; 5.99225; 5.26578 90; 93.116; 90 | 308.248 | Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B, 2001, 57, 20-26 |
| 9007690 | CIF | C Mn O3 | R -3 c :H | 4.772; 4.772; 15.637 90; 90; 120 | 308.379 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N. Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3 Sample: Synchrotron data Acta Crystallographica, Section B, 1995, 51, 929-939 |
| 2101387 | CIF Paper | C Mn O3 | R -3 c :H | 4.773; 4.773; 15.642 90; 90; 120 | 308.6 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N. Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO~3~, MgCO~3~ and MnCO~3~ Acta Crystallographica Section B, 1995, 51, 929-939 |
| 2101465 | CIF Paper | C4 H9 N O4 | P -1 | 7.483; 8.881; 4.731 91.29; 93.23; 100.24 | 308.7 | Hirano, A.; Kubozono, Y.; Maeda, H.; Ishida, H.; Kashino, S. Structure of ammonium hydrogen succinate above and below the phase transition around 170K Acta Crystallographica Section B, 1996, 52, 323-327 |
| 2107111 | CIF | Al Cs H8 N4 | P 4/n :2 | 7.579; 7.579; 5.375 90; 90; 90 | 308.747 | Molinie, P.; Brec, R.; Rouxel, J.; Herpin, P. Structures des amidoaluminates alcalins M Al (N H2)4, (M=Na,K,Cs). Structure de l'amidogallate de sodium Na Ga (N H2)4 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 925-934 |
| 2103307 | CIF Paper | C2 H5 N O2 | P 1 21/n 1 | 5.0993; 11.9416; 5.4608 90; 111.784; 90 | 308.78 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B, 2002, 58, 728-733 |
| 2105696 | CIF | C2 H5 N O2 | P 1 21/n 1 | 5.0993; 11.9416; 5.4608 90; 111.784; 90 | 308.78 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B Structural Science, 2002, 58, 728 |
| 2106041 | CIF | C4 H8 Cl2 Cu N8 O2 | P -1 | 5.42; 6.45; 9.31 74.5; 80.4; 84.7 | 308.847 | Chiesi, A.; Coghi, L.; Mangia, A.; Nardelli, M.; Pelizzi, G. The Crystal and Molecular Structure of Dichlorodiaquobis(dicyanamide)copper(II) Acta Crystallographica B (24,1968-38,1982), 1971, 27, 192-197 |
| 2105533 | CIF Paper | C6 H2 F4 O2 | P 1 21/n 1 | 6.5533; 4.8848; 10.148 90; 107.99; 90 | 308.97 | Thalladi, Venkat R.; Weiss, Hans-Christoph; Boese, Roland; Nangia, Ashwini; Desiraju, Gautam R. A comparative study of the crystal structures of tetrahalogenated hydroquinones and γ-hydroquinone Acta Crystallographica Section B, 1999, 55, 1005-1013 |
| 2100936 | CIF Paper | Ca2 Co O7 Si2 | P -4 21 m | 7.8417; 7.8417; 5.0249 90; 90; 90 | 308.99 | Hagiya, K.; Ohmasa, M.; Iishi, K. The modulated structure of synthetic Co-åkermanite, Ca~2~CoSi~2~O~7~ Acta Crystallographica Section B, 1993, 49, 172-179 |
| 2103308 | CIF Paper | C2 H5 N O2 | P 1 21/n 1 | 5.0999; 11.9516; 5.4594 90; 111.781; 90 | 309 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B, 2002, 58, 728-733 |
| 2105697 | CIF | C2 H5 N O2 | P 1 21/n 1 | 5.0999; 11.9516; 5.4594 90; 111.781; 90 | 309 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B Structural Science, 2002, 58, 728 |
| 2102009 | CIF Paper | F Nb O2 | R -3 c | 5.1232; 5.1232; 13.6017 90; 90; 120 | 309.18 | Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E. High-pressure transformations of NbO~2~F Acta Crystallographica Section B, 2000, 56, 189-196 |
| 2103309 | CIF Paper | C2 H5 N O2 | P 1 21/n 1 | 5.1008; 11.9558; 5.4602 90; 111.772; 90 | 309.23 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B, 2002, 58, 728-733 |
| 2105698 | CIF | C2 H5 N O2 | P 1 21/n 1 | 5.1008; 11.9558; 5.4602 90; 111.772; 90 | 309.23 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B Structural Science, 2002, 58, 728 |
| 2106184 | CIF | Ca H O4 P | P 1 | 6.91; 6.627; 6.998 96.34; 103.82; 88.33 | 309.275 | Catti, M.; Ferraris, G.; Filhol, A. Hydrogen bonding in the crystalline state. Ca H P O4 (monetite) , P1- or P1? A novel neutron diffraction study Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1223-1229 |
| 9007619 | CIF | Ca4 H4 O16 P4 | P -1 | 6.91; 6.627; 6.998 96.34; 103.82; 88.33 | 309.275 | Catti, M.; Ferraris, G.; Filhol, A. Hydrogen bonding in the crystalline state. CaHPO4 (monetite), P-1 or P1? A novel neutron diffraction study Acta Crystallographica, Section B, 1977, 33, 1223-1229 |
| 2107164 | CIF | H2 O | P 41 21 2 | 6.73; 6.73; 6.83 90; 90; 90 | 309.351 | Kamb, B.; Prakash, A. Structure of ice III Acta Crystallographica B (24,1968-38,1982), 1968, 24, 1317-1327 |
| 2103588 | CIF HKL Paper | Mo2 O8 Zr | C 1 2/m 1 | 9.7966; 5.98422; 5.28547 90; 93.069; 90 | 309.416 | Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B, 2001, 57, 20-26 |
| 2312142 | CIF HKL | C8 H14 Ni O12 | P -1 | 5.1335; 7.2734; 9.1031 107.952; 105.18; 92.139 | 309.472 | Pinto, Camila B.; Dos Santos, Leonardo H. R.; Rodrigues, Bernardo L. Experimental charge density and topological analysis of tetraaquabis(hydrogenmaleato)nickel(II): a comparison with Hirshfeld atom refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2102867 | CIF Paper | Mg0.75 O16 Rb1.51 Ti7.25 | I 4/m | 10.2052; 10.2052; 2.9717 90; 90; 90 | 309.49 | Michiue, Yuichi Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb) Acta Crystallographica, Section B, 2007, 63, 577-583 |
| 2102868 | CIF Paper | Mg0.75 O16 Rb1.51 Ti7.25 | I 4/m | 10.2052; 10.2052; 2.9717 90; 90; 90 | 309.49 | Michiue, Yuichi Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb) Acta Crystallographica, Section B, 2007, 63, 577-583 |
| 2102869 | CIF Paper | Mg0.75 O16 Rb1.5 Ti7.25 | I 4/m | 10.2052; 10.2052; 2.9717 90; 90; 90 | 309.49 | Michiue, Yuichi Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb) Acta Crystallographica, Section B, 2007, 63, 577-583 |
| 2102870 | CIF Paper | Mg0.75 O16 Rb1.5 Ti7.25 | I 4/m | 10.2052; 10.2052; 2.9717 90; 90; 90 | 309.49 | Michiue, Yuichi Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb) Acta Crystallographica, Section B, 2007, 63, 577-583 |
| 2102871 | CIF Paper | Mg0.76 O16 Rb1.51 Ti7.24 | I 4/m | 10.2052; 10.2052; 2.9717 90; 90; 90 | 309.49 | Michiue, Yuichi Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb) Acta Crystallographica, Section B, 2007, 63, 577-583 |
| 2103310 | CIF Paper | C2 H5 N O2 | P 1 21/n 1 | 5.1012; 11.9651; 5.4604 90; 111.763; 90 | 309.53 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B, 2002, 58, 728-733 |
| 2105699 | CIF | C2 H5 N O2 | P 1 21/n 1 | 5.1012; 11.9651; 5.4604 90; 111.763; 90 | 309.53 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B Structural Science, 2002, 58, 728 |
| 9011169 | CIF | O2 Sb | P n a 21 | 5.456; 4.814; 11.787 90; 90; 90 | 309.588 | Thornton, G. A neutron diffraction study of a-Sb2O4 Acta Crystallographica, Section B, 1977, 33, 1271-1273 |
| 2106742 | CIF | C N Na S | P n m a | 13.38; 4.09; 5.66 90; 90; 90 | 309.739 | van Rooyen, P.H.; Boeyens, J.C.A. Sodium thiocyanate Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2933-2934 |
| 2103311 | CIF Paper | C2 H5 N O2 | P 1 21/n 1 | 5.1026; 11.9752; 5.4602 90; 111.757; 90 | 309.88 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B, 2002, 58, 728-733 |
| 2105700 | CIF | C2 H5 N O2 | P 1 21/n 1 | 5.1026; 11.9752; 5.4602 90; 111.757; 90 | 309.88 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B Structural Science, 2002, 58, 728 |
| 2106179 | CIF | Ca2 Mg O7 Si2 | P -4 21 m | 7.86; 7.86; 5.024 90; 90; 90 | 310.381 | Bindi, L.; Chapuis, G.; Bonazzi, P.; Petricek, V.; Dusek, M. Five-dimensional structure refinement of natural melilite, (Ca1.89 Sr0.01 Na0.08 K0.02) (Mg0.92 Al0.08) (Si1.98 Al0.02) O7 Acta Crystallographica B (39,1983-), 2001, 57, 739-746 |
| 2105338 | CIF | Ag Bi Cr2 O8 | I -4 | 5.1064; 5.1064; 11.9091 90; 90; 90 | 310.534 | Riou, A.; Roult, G. Etude par diffraction neutronique en tempy de vol de la structure cristalline Acta Crystallographica B (24,1968-38,1982), 1979, 35, 2494-2499 |
| 2100573 | CIF Paper | Ba2 Bi O6 Sb | I 1 2/m 1 | 6.06777; 6.01862; 8.50818 90; 90.2161; 90 | 310.713 | Kennedy, Brendan J.; Howard, Christopher J.; Knight, Kevin S.; Zhang, Zhaoming; Zhou, Qingdi Structures and phase transitions in the ordered double perovskites Ba~2~Bi^III^Bi^V^O~6~ and Ba~2~Bi^III^Sb^V^O~6~ Acta Crystallographica Section B, 2006, 62, 537-546 |
| 2100346 | CIF Paper | C3 H9 Cl Si | P m n 21 | 7.768; 6.42; 6.233 90; 90; 90 | 310.8 | Roman Gajda; Kamil F. Dziubek; Andrzej Katrusiak Absence of halogen···halogen interactions in chlorotrimethylsilane polymorphs Acta Crystallographica Section B, 2006, 62, 86-93 |
| 2104604 | CIF Paper | C10 H8 Cu F6 O4 | P -1 | 4.7559; 8.1563; 8.6068 92.436; 102.362; 106.146 | 311.4 | Marsh, Richard E. Space groups <i>P</i>1 and <i>Cc</i>: how are they doing? Acta Crystallographica Section B, 2009, 65, 782-783 |
| 2107479 | CIF HKL Paper | Cr Fe O3 | R -3 :H | 5.077; 5.077; 13.9621 90; 90; 120 | 311.67 | Pérez-Cruz, María Ana; Elizalde-González, María de la Paz; Escudero, Roberto; Bernès, Sylvain; Silva-González, Rutilo; Reyes-Ortega, Yasmi At last! The single-crystal X-ray structure of a naturally occurring sample of the ilmenite-type oxide FeCrO~3~ Acta Crystallographica Section B, 2015, 71, 555-561 |
| 9011133 | CIF | Cu3 S4 Sb | I -4 2 m | 5.385; 5.385; 10.754 90; 90; 90 | 311.847 | Garin, J.; Parthe, E. The crystal structure of Cu3PSe4 and other ternary normal tetrahedral structure compounds with composition 1_356_4 Acta Crystallographica, Section B, 1972, 28, 3672-3674 |
| 1008103 | CIF | Li Mo2 O8 Y | P -1 | 6.7296; 10.2792; 5.1916 100.26; 113.73; 71.94 | 312 | le Page, Y; Strobel, P Structure of Lithium Yttrium Bismolybdate(VI) Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1919-1920 |
| 2100635 | CIF Paper | F3 Fe | R -3 c :H | 5.1979; 5.1979; 13.339 90; 90; 120 | 312.11 | Jørgensen, Jens-Erik; Smith, R. I. On the compression mechanism of FeF~3~ Acta Crystallographica Section B, 2006, 62, 987-992 |
| 2103587 | CIF HKL Paper | Mo2 O8 Zr | C 1 2/m 1 | 9.8256; 5.9898; 5.31146 90; 93.039; 90 | 312.158 | Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B, 2001, 57, 20-26 |
| 2105049 | CIF HKL Paper | Li0.63 Zn0.87 | R -3 m :H | 4.386; 4.386; 18.738 90; 90; 120 | 312.2 | Pavlyuk, Volodymyr; Chumak, Ihor; Ehrenberg, Helmut Polymorphism of Li~2~Zn~3~ Acta Crystallographica Section B, 2012, 68, 34-39 |
| 2102160 | CIF Paper | Ca1.74 Co O7 Si2 Sr0.26 | P -4 21 m | 7.8743; 7.8743; 5.0417 90; 90; 90 | 312.61 | Bagautdinov, B.; Hagiya, K.; Kusaka, K.; Ohmasa, M.; Iishi, K. Two-dimensional incommensurately modulated structure of (Sr~0.13~Ca~0.87~)~2~CoSi~2~O~7~ crystals Acta Crystallographica Section B, 2000, 56, 811-821 |
| 2103312 | CIF Paper | C2 H5 N O2 | P 1 21/n 1 | 5.1074; 12.0775; 5.4596 90; 111.827; 90 | 312.63 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B, 2002, 58, 728-733 |
| 2105701 | CIF | C2 H5 N O2 | P 1 21/n 1 | 5.1074; 12.0775; 5.4596 90; 111.827; 90 | 312.63 | Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B Structural Science, 2002, 58, 728 |
| 2108161 | CIF | D3 O4 P | P 1 21/c 1 | 5.6927; 4.81609; 11.4468 90; 94.704; 90 | 312.77 | Bull, Craig L.; Funnell, Nicholas P.; Pulham, Colin R.; Marshall, William G.; Allan, David R. A new high-pressure polymorph of phosphoric acid Acta Crystallographica Section B, 2017, 73, 1068-1074 |
| 2103586 | CIF HKL Paper | Mo2 O8 Zr | C 1 2/m 1 | 9.8358; 5.98562; 5.32344 90; 93.004; 90 | 312.978 | Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B, 2001, 57, 20-26 |
| 2100345 | CIF Paper | C3 H9 Cl Si | P m n 21 | 7.785; 6.43; 6.254 90; 90; 90 | 313.1 | Roman Gajda; Kamil F. Dziubek; Andrzej Katrusiak Absence of halogen···halogen interactions in chlorotrimethylsilane polymorphs Acta Crystallographica Section B, 2006, 62, 86-93 |
| 2108158 | CIF | H3 O4 P | P 1 21/c 1 | 5.707; 4.82; 11.436 90; 94.75; 90 | 313.5 | Bull, Craig L.; Funnell, Nicholas P.; Pulham, Colin R.; Marshall, William G.; Allan, David R. A new high-pressure polymorph of phosphoric acid Acta Crystallographica Section B, 2017, 73, 1068-1074 |
| 9011124 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.025; 10.3; 3.799 90; 90; 90 | 314.016 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: NOX(XR) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011127 | CIF | C2 H2 N2 O5 | P 21 21 2 | 8.025; 10.3; 3.799 90; 90; 90 | 314.016 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: NOX(N) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 2106323 | CIF | Br3 Mn Rb | P 63/m m c | 7.56; 7.56; 6.35 90; 90; 120 | 314.303 | Goodyear, J.; Ali, E.M.; Sutherland, H.H. Rubidium tribromomanganate Acta Crystallographica B (24,1968-38,1982), 1980, 36, 671-672 |
| 9011123 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.035; 10.309; 3.795 90; 90; 90 | 314.351 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: HOX(XR) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011126 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.035; 10.309; 3.795 90; 90; 90 | 314.351 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: HOX(N) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 2106210 | CIF | O3 Ti1.85 | R -3 c :H | 5.1417; 5.1417; 13.731 90; 90; 120 | 314.374 | Rice, C.E.; Robinson, W.R. High-temperature crystal chemistry of Ti2 O3 : structural changes accompanying the semiconductor-metal transition Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1342-1348 |
| 2105801 | CIF HKL Paper | Gd K S2 | R -3 m :H | 4.0715; 4.0715; 21.901 90; 90; 120 | 314.42 | Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series Acta Crystallographica Section B, 2014, 70, 360-371 |
| 2106406 | CIF | Ni0.9 O8 P2 Zn2.1 | P 1 21/n 1 | 7.505; 8.316; 5.056 90; 94.48; 90 | 314.589 | Nord, A.G.; Stefanidis, T. A neutron diffraction study of gamma-(Zn0.7 Ni0.3)3 (P O4)2 Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1509-1511 |
| 2108107 | CIF HKL Paper | C4 H12 I4 N2 | P -1 | 6.4948; 7.4032; 8.0819 64.087; 67.276; 69.593 | 314.73 | Bujak, Maciej Formation and distortion of iodidoantimonates(III): the first isolated [SbI~6~]^3{-^} octahedron Acta Crystallographica Section B, 2017, 73, 432-442 |
| 2022073 | CIF | C1.25 H3 O | I -4 | 6.0867; 6.0867; 8.4958 90; 90; 90 | 314.752 | Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76 |
| 2100483 | CIF HKL Paper | C5 H12 O4 | I -4 | 6.0867; 6.0867; 8.4958 90; 90; 90 | 314.752 | Elizabeth A.Zhurova; Vladimir G. Tsirelson; Vladimir V. Zhurov; Adam I. Stash; A. Alan Pinkerton Chemical bonding in pentaerythritol at very low temperature or at high pressure: an experimental and theoretical study Acta Crystallographica Section B, 2006, 62, 513-520 |
| 2106209 | CIF | O3 Ti1.886 | R -3 c :H | 5.1286; 5.1286; 13.839 90; 90; 120 | 315.234 | Rice, C.E.; Robinson, W.R. High-temperature crystal chemistry of Ti2 O3 : structural changes accompanying the semiconductor-metal transition Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1342-1348 |
| 2107186 | CIF | C2 D10 N2 O5 | P 21 21 2 | 8.027; 10.298; 3.816 90; 90; 90 | 315.438 | Taylor, J.C.; Sabine, T.M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Acta Crystallographica B (24,1968-38,1982), 1972, 28, 3340-3351 |
| 9011125 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.027; 10.298; 3.816 90; 90; 90 | 315.438 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: DOX(XR) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011128 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.027; 10.298; 3.816 90; 90; 90 | 315.438 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: DOX(N) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 2311711 | CIF | Li O3 Ta | R 3 c :H | 5.148; 5.148; 13.767 90; 90; 120 | 315.97 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2106537 | CIF | Si U3 | I 4/m c m | 6.033; 6.033; 8.69 90; 90; 90 | 316.291 | Kimmel, G. Atomic positions in U3 Si Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1351-1353 |
| 2311710 | CIF | Li Nb0.08 O3 Ta0.92 | R 3 c :H | 5.149; 5.149; 13.781 90; 90; 120 | 316.42 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2311708 | CIF | Li Nb0.36 O3 Ta0.64 | R 3 c :H | 5.149; 5.149; 13.786 90; 90; 120 | 316.53 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2311709 | CIF | Li Nb0.11 O3 Ta0.89 | R 3 c :H | 5.151; 5.151; 13.776 90; 90; 120 | 316.55 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2311707 | CIF | Li Nb0.4 O3 Ta0.6 | R 3 c :H | 5.147; 5.147; 13.798 90; 90; 120 | 316.56 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2106927 | CIF | F4 Na Ti | P b c n | 4.976; 5.755; 11.07 90; 90; 90 | 317.01 | Omaly, J.; Avignant, D.; Batail, P.; Grandjean, D.; Cousseins, J.C. Structure cristalline de alpha-Na Ti F4 Acta Crystallographica B (24,1968-38,1982), 1976, 32, 2106-2110 |
| 2101846 | CIF Paper | Li O3 Ta | R 3 c :H | 5.154; 5.154; 13.783 90; 90; 120 | 317.1 | Hsu, R.; Maslen, E. N.; du Boulay, D.; Ishizawa, N. Synchrotron X-ray Studies of LiNbO~3~ and LiTaO~3~ Acta Crystallographica Section B, 1997, 53, 420-428 |
| 2106200 | CIF | Cl4 Mn Na2 | P b a m | 6.93; 11.86; 3.86 90; 90; 90 | 317.253 | Goodyear, J.; Ali, S.A.D.; Steigmann, G.A. The crystal structure of Na2 Mn Cl4 Acta Crystallographica B (24,1968-38,1982), 1971, 27, 1672-1674 |
| 2311705 | CIF | Li Nb0.7 O3 Ta0.3 | R 3 c :H | 5.145; 5.145; 13.841 90; 90; 120 | 317.3 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 9007526 | CIF | O4 Si Zn2 | I -4 2 d | 7.0069; 7.0069; 6.4637 90; 90; 90 | 317.346 | Marumo, F.; Syono, Y. The crystal structure of Zn2SiO4-II, a high-pressure phase of willemite Acta Crystallographica, Section B, 1971, 27, 1868-1870 |
| 2105800 | CIF HKL Paper | Eu K S2 | R -3 m :H | 4.0981; 4.0981; 21.8212 90; 90; 120 | 317.38 | Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series Acta Crystallographica Section B, 2014, 70, 360-371 |
| 2103357 | CIF Paper | C2 H3 N2 P | P 32 2 1 | 8.154; 8.154; 5.512 90; 90; 120 | 317.381 | Marsh, Richard E. The space groups of point group <i>C</i>~3~: some corrections, some comments Acta Crystallographica Section B, 2002, 58, 893-899 |
| 2311706 | CIF | Li Nb0.47 O3 Ta0.53 | R 3 c :H | 5.147; 5.147; 13.834 90; 90; 120 | 317.39 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2103585 | CIF HKL Paper | Mo2 O8 Zr | C 1 2/m 1 | 9.8821; 5.9699; 5.3888 90; 92.818; 90 | 317.529 | Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B, 2001, 57, 20-26 |
| 2107150 | CIF | Li5.04 O17.92 Ta6.16 | R 3 :H | 5.1576; 5.1576; 13.7842 90; 90; 120 | 317.547 | Santoro, A.; Roth, R.S.; Austin, M. Powder neutron diffraction study of the nonstoichiometric solid solution of lithium tantalate (Li Ta O3)9 (Ta2 O5) Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1094-1098 |
| 2107119 | CIF | Cd Cu2 Ge S4 | P m n 21 | 7.692; 6.555; 6.299 90; 90; 90 | 317.602 | Parthe, E.; Yvon, K.; Deitch, R.H. The Crystal Structure of Cu2 Cd Ge S4 and Other Quaternary Normal Tetrahedral Structure Compounds Acta Crystallographica B (24,1968-38,1982), 1969, 25, 1164-1174 |
| 2106429 | CIF | As O4 Tb | I 41/a m d :1 | 7.09; 7.09; 6.32 90; 90; 90 | 317.694 | Schaefer, W.P.; Will, G.; Mueller-Vogt, G. Refinement of the crystal structure of terbium arsenate Tb As O4 at 77 K and 5 K by profile analysis from neutron diffraction powder data Acta Crystallographica B (24,1968-38,1982), 1979, 35, 588-592 |
| 2311704 | CIF Paper | Li Nb O3 | R 3 c :H | 5.146; 5.146; 13.859 90; 90; 120 | 317.84 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2101845 | CIF Paper | Li Nb O3 | R 3 c :H | 5.148; 5.148; 13.863 90; 90; 120 | 318.2 | Hsu, R.; Maslen, E. N.; du Boulay, D.; Ishizawa, N. Synchrotron X-ray Studies of LiNbO~3~ and LiTaO~3~ Acta Crystallographica Section B, 1997, 53, 420-428 |
| 9011205 | CIF | O5 Sb2 | C 1 2/c 1 | 12.646; 4.782; 5.4247 90; 103.91; 90 | 318.429 | Jansen, M. Die kristallstruktur von antimon(V)-oxid Acta Crystallographica, Section B, 1979, 35, 539-542 |
| 2107115 | CIF | Ba Fe4 O7 | P 63/m | 5.16; 5.16; 13.811 90; 90; 120 | 318.46 | Okamoto, S.; Okamoto, S.I.; Ito, T. The crystal structure of barium diferrite Acta Crystallographica B (24,1968-38,1982), 1973, 29, 832-838 |
| 2101175 | CIF Paper | Li Nb O3 | R 3 c :H | 5.1513; 5.1513; 13.8654 90; 90; 120 | 318.64 | Boysen, H.; Altorfer, F. A neutron powder investigation of the high-temperature structure and phase transition in LiNbO~3~ Acta Crystallographica Section B, 1994, 50, 405-414 |
| 2109081 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.2524; 9.4479; 6.535 90; 100.664; 90 | 318.69 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 9011137 | CIF | O4 V Y | I 41/a m d :2 | 7.12; 7.12; 6.289 90; 90; 90 | 318.817 | Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C. Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic Acta Crystallographica, Section B, 1973, 29, 141-142 |
| 2105140 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 12.582; 8.965; 2.9572 90; 107.05; 90 | 318.905 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2106100 | CIF | Mg Ni2 | P 63/m m c | 4.824; 4.824; 15.826 90; 90; 120 | 318.945 | Komura, Y.; Tokunaga, K. Structural studies of stacking variants in Mg-base Friauf- Laves phases Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1548-1554 |
| 2107428 | CIF | Co O8 P2 Zn2 | P 1 21/n 1 | 7.536; 8.413; 5.049 90; 94.74; 90 | 319.014 | Nord, A.G. Crystallographic Studies of the Farringtonite-type Phases gamma-Zn2 Co (P O4)2 and gamma-(Zn.5 Co.5)3 (P O4)2 Acta Crystallographica B (39,1983-), 1984, 40, 191-194 |
| 2311787 | CIF | Ba2 F2 Lu2 O12 Si4 | P -1 | 5.451; 7.1227; 8.8937 107.73; 101.81; 93.01 | 319.5 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2107429 | CIF | Co3 O16 P4 Zn3 | P 1 21/n 1 | 7.545; 8.406; 5.054 90; 94.56; 90 | 319.527 | Nord, A.G. Crystallographic Studies of the Farringtonite-type phases gamma-Zn2 Co (P O4)2 and gamma-(Zn.5 Co.5)3 (P O4)2 Acta Crystallographica B (39,1983-), 1984, 40, 191-194 |
| 2311786 | CIF | Ba2 F2 O12 Si4 Yb2 | P -1 | 5.4461; 7.1212; 8.9128 107.798; 101.866; 92.9455 | 319.66 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2101954 | CIF Paper | B3 Li O5 | P n a 21 | 8.444; 7.378; 5.1416 90; 90; 90 | 320.32 | Le Hénaff, C.; Hansen, N. K.; Protas, J.; Marnier, G. Electron Density Distribution in LiB~3~O~5~ at 293 K Acta Crystallographica Section B, 1997, 53, 870-879 |
| 2105813 | CIF HKL Paper | Cu2 S4 Sn Zn | I -4 2 m | 5.4353; 5.4353; 10.8464 90; 90; 90 | 320.43 | Lafond, Alain; Choubrac, Léo; Guillot-Deudon, Catherine; Fertey, Pierre; Evain, Michel; Jobic, Stéphane X-ray resonant single-crystal diffraction technique, a powerful tool to investigate the kesterite structure of the photovoltaic Cu~2~ZnSnS~4~ compound Acta Crystallographica Section B, 2014, 70, 390-394 |
| 2100605 | CIF HKL Paper | C10 H8 | P 1 21/a 1 | 7.8523; 5.8106; 8.474 90; 124.027; 90 | 320.44 | F. P. A. Fabbiani; D. R. Allan; S. Parsons; C. R. Pulham Exploration of the high-pressure behaviour of polycyclic aromatic hydrocarbons: naphthalene, phenanthrene and pyrene Acta Crystallographica Section B, 2006, 62, 826-842 |
| 9011234 | CIF | As Bi O4 | P 1 21/n 1 | 6.879; 7.159; 6.732 90; 104.84; 90 | 320.471 | Bedlivy, D.; Mereiter, K. Structure of alpha-BiAsO4 (rooseveltite) Note: AnisoU's from ICSD Acta Crystallographica, Section B, 1982, 38, 1559-1561 |
| 2101343 | CIF Paper | H3 O4 P | P 1 21/c 1 | 5.7572; 4.831; 11.574 90; 95.274; 90 | 320.55 | Souhassou, M.; Espinosa, E.; Lecomte, C.; Blessing, R. H. Experimental electron density in crystalline H~3~PO~4~ Acta Crystallographica Section B, 1995, 51, 661-668 |
| 2105963 | CIF | C2 Ca Mg O6 | R -3 :H | 4.808; 4.808; 16.022 90; 90; 120 | 320.76 | Pilati, T.; Demartin, F.; Gramaccioli, C. M. Lattice-dynamical estimation of atomic displacement parameters in carbonates: Calcite and aragonite Ca C O3, dolomite Ca Mg (C O3)2, and magnesite Mg C O3 Acta Crystallographica Section B, 1998, 54, 515-523 |
| 9011160 | CIF | Ce F3 | P -3 c 1 | 7.131; 7.131; 7.286 90; 90; 120 | 320.864 | Cheetham, A. K.; Fender, B. E. F.; Fuess, H.; Wright, A. F. A powder neutron diffraction study of lanthanum and cerium trifluorides Acta Crystallographica, Section B, 1976, 32, 94-97 |
| 2100670 | CIF Paper | C2 H8 N2 | P 1 21/c 1 | 9.69; 7.488; 4.849 90; 114; 90 | 321 | Budzianowski, Armand; Olejniczak, Anna; Katrusiak, Andrzej Competing hydrogen-bonding patterns and phase transitions of 1,2-diaminoethane at varied temperature and pressure Acta Crystallographica Section B, 2006, 62, 1078-1089 |
| 2311723 | CIF | C4 Cl4 Fe N | P m -3 m | 6.847; 6.847; 6.847 90; 90; 90 | 321 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 9007623 | CIF | C0.5 H4 Mg O4 | C 1 2/m 1 | 16.56; 3.153; 6.231 90; 99.1; 90 | 321.249 | Akao, M.; Iwai, S. The hydrogen bonding of artinite Note: anisotropic displacement parameters obtained from ICSD Acta Crystallographica, Section B, 1977, 33, 3951-3953 |
| 2108168 | CIF | D3 O4 P | P 1 21/c 1 | 5.7466; 4.8378; 11.6028 90; 95.107; 90 | 321.29 | Bull, Craig L.; Funnell, Nicholas P.; Pulham, Colin R.; Marshall, William G.; Allan, David R. A new high-pressure polymorph of phosphoric acid Acta Crystallographica Section B, 2017, 73, 1068-1074 |
| 2311729 | CIF | C4 Cl4 Ga N | P m -3 m | 6.8504; 6.8504; 6.8504 90; 90; 90 | 321.48 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 9007624 | CIF | O4 Si Th | I 41/a m d :2 | 7.1328; 7.1328; 6.3188 90; 90; 90 | 321.481 | Taylor, M.; Ewing, R. C. The crystal structure of the ThSiO4 polymorphs: huttonite and thorite Acta Crystallographica, Section B, 1978, 34, 1074-1079 |
| 2311785 | CIF | Ba2 F2 O12 Si4 Tm2 | P -1 | 5.4609; 7.1258; 8.9379 107.809; 101.987; 92.866 | 321.5 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2106109 | CIF | Ho Zn3 | P n m a | 6.697; 4.3655; 10.999 90; 90; 90 | 321.564 | Michel, D.J.; Ryba, E. The crystal structure of Ho Zn3 Acta Crystallographica B (24,1968-38,1982), 1968, 24, 1267-1269 |
| 2102008 | CIF Paper | F Nb O2 | R -3 c | 5.2357; 5.2357; 13.5542 90; 90; 120 | 321.78 | Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E. High-pressure transformations of NbO~2~F Acta Crystallographica Section B, 2000, 56, 189-196 |
| 2108160 | CIF | D3 O4 P | P 1 21/c 1 | 5.7493; 4.83921; 11.617 90; 95.15; 90 | 321.9 | Bull, Craig L.; Funnell, Nicholas P.; Pulham, Colin R.; Marshall, William G.; Allan, David R. A new high-pressure polymorph of phosphoric acid Acta Crystallographica Section B, 2017, 73, 1068-1074 |
| 2103565 | CIF HKL Paper | C3 H9 Cl N2 O2 | P 1 21 1 | 7.562; 4.9986; 8.519 90; 90.76; 90 | 321.98 | In, Yasuko; Fujii, Mayumi; Sasada, Yasuhiro; Ishida, Toshimasa Structural studies on C-amidated amino acids and peptides: structures of hydrochloride salts of C-amidated Ile, Val, Thr, Ser, Met, Trp, Gln and Arg, and comparison with their C-unamidated counterparts Acta Crystallographica Section B, 2001, 57, 72-81 |
| 2101573 | CIF Paper | Ba0.6 Bi K0.4 O2.3 | P b a 2 | 6.127; 12.016; 4.378 90; 90; 90 | 322.317 | Abrahams, S. C.; Mirsky, K.; Nielson, R. M. Prediction of ferroelectricity in recent Inorganic Crystal Structure Database entries under space group <i>Pba</i>2 Acta Crystallographica Section B, 1996, 52, 806-809 |
| 2106092 | CIF | Mo P4 | C 1 2/c 1 | 5.313; 11.139; 5.82 90; 110.64; 90 | 322.328 | Jeitschko, W.; Donohue, P.C. The high pressure synthesis, crystal structure, and properties of Cr P4 and Mo P4 Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1893-1898 |
| 2105139 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 12.6235; 8.9926; 2.9704 90; 107.076; 90 | 322.33 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2101342 | CIF Paper | H3 O4 P | P 1 21/c 1 | 5.779; 4.826; 11.61 90; 95.26; 90 | 322.4 | Moss, G. R.; Souhassou, M.; Blessing, R. H.; Espinosa, E.; Lecomte, C. Computational studies of crystalline H~3~PO~4~ Acta Crystallographica Section B, 1995, 51, 650-660 |
| 2107052 | CIF | D4 N2 O3 | P n m a | 7.7184; 5.8447; 7.1624 90; 90; 90 | 323.108 | Lucas, B.W.; Ahtee, M.; Hewat, A.W. The structure of phase III ammonium nitrate Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2005-2008 |
| 2103127 | CIF Paper | C14 H14 N2 O5 | P 1 | 5.1647; 6.2749; 10.2126 83.235; 89.808; 79.601 | 323.21 | Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines Acta Crystallographica, Section B, 2002, 58, 530-544 |
| 2022903 | CIF HKL Paper | B3 Ca H7 O9 | P -1 | 6.465; 8.059; 6.388 89.922; 103.38; 86.859 | 323.3 | Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite) Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945 |
| 2105804 | CIF HKL Paper | Rb S2 Y | R -3 m :H | 4.0444; 4.0444; 22.8267 90; 90; 120 | 323.36 | Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series Acta Crystallographica Section B, 2014, 70, 360-371 |
| 1008033 | CIF | Co3 O8 U2 | P n n m | 5.11; 10.3; 6.15 90; 90; 90 | 323.7 | Bacmann, M Structure cristalline du nouveau compose Co U~2~ O~8~ Acta Crystallographica B (24,1968-38,1982), 1973, 29, 1570-1572 |
| 2102966 | CIF HKL Paper | C H2 Br Cl | P b c n | 4.1126; 8.0685; 9.755 90; 90; 90 | 323.7 | Podsiadło, Marcin; Katrusiak, Andrzej Isobaric and isochoric freezing of CH~2~BrCl and isostructural relations between CH~2~Cl~2~, CH~2~Br~2~ and CH~2~BrCl Acta Crystallographica Section B, 2007, 63, 903-911 |
| 2106468 | CIF | F Li O3 S | C 1 2/m 1 | 8.54; 7.62; 4.98 90; 90; 90 | 324.073 | Zak, Z.; Kosicka, M. The crystal structure of lithium fluorosulphate Li S O3 F Acta Crystallographica B (24,1968-38,1982), 1978, 34, 38-40 |
| 2108106 | CIF HKL Paper | C4 H12 I4 N2 | P -1 | 6.5154; 7.4946; 8.1299 64.759; 68.019; 69.5 | 324.27 | Bujak, Maciej Formation and distortion of iodidoantimonates(III): the first isolated [SbI~6~]^3{-^} octahedron Acta Crystallographica Section B, 2017, 73, 432-442 |
| 2311784 | CIF | Ba2 Er2 F2 O12 Si4 | P -1 | 5.476; 7.166; 8.958 108.138; 102.03; 92.742 | 324.3 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2103481 | CIF HKL Paper | C9 H18 N4 O6 | P 1 | 5.353; 6.931; 9.922 69.53; 89.035; 71.128 | 324.4 | Saraswathi, N. T.; Vijayan, M. X-ray studies on crystalline complexes involving amino acids and peptides. XL. Conformational variability, recurring and new features of aggregation, and effect of chirality in the malonic acid complexes of <small>DL</small>- and <small>L</small>-arginine Acta Crystallographica Section B, 2002, 58, 1051-1056 |
| 2107039 | CIF | Br3 Cr Cs | P 63 m c | 7.588; 7.588; 6.506 90; 90; 120 | 324.414 | Li, T.I.; Stucky, G.D. The effect of exchange coupling on the spectra of transition metal ions. The crystal structure and optical spectrum of Cs Cr Br3 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 1529-1532 |
| 2104548 | CIF Paper | C10 H8 F6 O4 Pt | P -1 | 4.8969; 8.0055; 9.001 80.439; 75.416; 72.802 | 324.614 | Marsh, Richard E. Space groups <i>P</i>1 and <i>Cc</i>: how are they doing? Acta Crystallographica Section B, 2009, 65, 782-783 |
| 2106117 | CIF | In O4 V | C m c m | 5.765; 8.542; 6.592 90; 90; 90 | 324.621 | Touboul, M.; Toledano, P. Structure du vanadate d'indium: In V O4 Acta Crystallographica B (24,1968-38,1982), 1980, 36, 240-245 |
| 2022902 | CIF HKL Paper | B3 Ca H7 O9 | P -1 | 6.478; 8.0733; 6.3923 89.972; 103.3; 86.857 | 324.82 | Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite) Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945 |
| 9014630 | CIF | Mn2 O4 Si | P b n m | 4.9023; 10.5964; 6.2567 90; 90; 90 | 325.015 | Fujino, K.; Sasaki, S.; Takeuchi, Y.; Sadanaga, R. X-ray determination of electron distributions in forsterite, fayalite and tephroite Acta Crystallographica, Section B, 1981, 37, 513-518 |
| 2109080 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.2831; 9.491; 6.5957 90; 100.623; 90 | 325.05 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2106898 | CIF | Al4 Ba2 H16 O16 | P -1 | 5.65; 6.821; 8.943 99.4; 92.31; 106.1 | 325.352 | Dent Glasser, L.S.; Giovanoli, R. Barium aluminate hydrates. IV. The crystal structure of alpha Ba2 (Al4 (O H)16) Acta Crystallographica B (24,1968-38,1982), 1972, 28, 519-524 |
| 2105138 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 12.6665; 9.0153; 2.9827 90; 107.13; 90 | 325.492 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2107005 | CIF | Hg Mo O4 | C 1 2/c 1 | 11.282; 6.055; 5.154 90; 112.27; 90 | 325.82 | Jeitschko, W.; Sleight, A.W. The crystal structure of Hg Mo O4 and related compounds Acta Crystallographica B (24,1968-38,1982), 1973, 29, 869-875 |
| 1000060 | CIF | Al2 O5 Ti | B b m m | 9.429; 9.636; 3.591 90; 90; 90 | 326.3 | Morosin, B; Lynch, R W Structure studies on Al~2~ Ti O~5~ at room temperature and at 600C Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1040-1046 |
| 2102781 | CIF Paper | Ba O9 V4 | P 1 2/c 1 | 7.6084; 4.9291; 9.3464 90; 111.371; 90 | 326.41 | Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G. Synthesis and structural characterization of BaV~4~O~9~ Acta Crystallographica Section B, 2007, 63, 270-276 |
| 9007673 | CIF | Mn O3 Ti | R -3 :H | 5.139; 5.139; 14.283 90; 90; 120 | 326.669 | Kidoh, K.; Tanaka, K.; Marumo, F.; Takei, H. Electron density distribution in ilmenite-type crystals. II. Manganese (II) titanium (IV) trioxide Sample: ilmenite structure Acta Crystallographica, Section B, 1984, 40, 329-332 |
| 2102780 | CIF Paper | Ba O9 V4 | P 1 2/c 1 | 7.614; 4.9319; 9.347 90; 111.371; 90 | 326.86 | Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G. Synthesis and structural characterization of BaV~4~O~9~ Acta Crystallographica Section B, 2007, 63, 270-276 |
| 2106452 | CIF | Ba2 Bi2 O6 | I 1 2/m 1 | 6.1736; 6.1237; 8.6507 90; 90.29; 90 | 327.038 | Thornton, G.; Jacobson, A.J. A neutron diffraction determination of the structures of Ba2 Sb(V) Bi(III) O6 and Ba2 Bi(V) Bi(III) O6 Acta Crystallographica B (24,1968-38,1982), 1978, 34, 351-354 |
| 9007637 | CIF | As O2 | P n m a | 8.597; 5.235; 7.269 90; 90; 90 | 327.143 | Jones, P. G.; Beesk, W.; Sheldrick, G. M.; Schwarzmann, E. Arsenic dioxide Acta Crystallographica, Section B, 1980, 36, 439-440 |
| 9011134 | CIF | Cu3 P Se4 | P m n 21 | 7.697; 6.661; 6.381 90; 90; 90 | 327.152 | Garin, J.; Parthe, E. The crystal structure of Cu3PSe4 and other ternary normal tetrahedral structure compounds with composition 1_356_4 Acta Crystallographica, Section B, 1972, 28, 3672-3674 |
| 2100569 | CIF Paper | Ba Bi O3 | P 1 21/n 1 | 6.1741; 6.12484; 8.6522 90; 90.2691; 90 | 327.183 | Kennedy, Brendan J.; Howard, Christopher J.; Knight, Kevin S.; Zhang, Zhaoming; Zhou, Qingdi Structures and phase transitions in the ordered double perovskites Ba~2~Bi^III^Bi^V^O~6~ and Ba~2~Bi^III^Sb^V^O~6~ Acta Crystallographica Section B, 2006, 62, 537-546 |
| 2002963 | CIF Paper | C2 H18 F6 N8 O2 Si | P -1 | 6.5124; 6.6952; 8.0215 70.723; 82.745; 89.243 | 327.348 | Ross II, Charles R.; Bauer, M.R.; Nielson, R.M; Abrahams, S.C. Anhydrous ammonioguanidinium(2+) and dihydrated bis[aminoguanidinium(1+)] hexafluorosilicates: new co-products of preparing ferroelectric ammonioguanidinium(2+) hexafluorozirconate Acta Crystallographica Section B, 1999, 55, 246-254 |
| 2106816 | CIF | Li2 O4 S | P 1 21/c 1 | 8.45; 4.95; 8.21 90; 107.5; 90 | 327.51 | Alcock, N.W.; Evans, D.A.; Jenkins, H.D.B. Lithium sulfate - a redetermination Acta Crystallographica B (24,1968-38,1982), 1973, 29, 360-361 |
| 9007595 | CIF | O4 Sn W | P n n a | 5.627; 11.6486; 4.9973 90; 90; 90 | 327.556 | Jeitschko, W.; Sleight, A. W. Alpha stannous tungstate: Properties, crystal structure and relationship to ferroelectric SbTaO4 type compounds Acta Crystallographica, Section B, 1974, 30, 2088-2094 |
| 2106479 | CIF | O5 V3 | P 1 2/c 1 | 9.859; 5.0416; 6.991 90; 109.478; 90 | 327.602 | Asbrink, S. The crystal structure of and valency distribution in the low-temperature modification of V3 O5. The decisive importance of a few very weak reflexions in a crystal-structure Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1332-1339 |
| 2102779 | CIF Paper | Ba O9 V4 | P 1 2/c 1 | 7.6231; 4.937; 9.3528 90; 111.386; 90 | 327.76 | Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G. Synthesis and structural characterization of BaV~4~O~9~ Acta Crystallographica Section B, 2007, 63, 270-276 |
| 2107434 | CIF | Ba0.7 Cr1.4 O8 Sn1.6 | C 1 2/m 1 | 14.728; 3.108; 10.012 90; 134.27; 90 | 328.166 | Cadee, M.C.; Verschoor, G.C. Barium tin chromium oxide, a new hollandite phase Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3554-3558 |
| 2102778 | CIF Paper | Ba O9 V4 | P 1 2/c 1 | 7.6303; 4.9405; 9.3547 90; 111.395; 90 | 328.35 | Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G. Synthesis and structural characterization of BaV~4~O~9~ Acta Crystallographica Section B, 2007, 63, 270-276 |
| 2105137 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 12.699; 9.039; 2.9943 90; 107.18; 90 | 328.369 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2100570 | CIF Paper | Ba Bi O3 | I 1 2/m 1 | 6.18505; 6.13219; 8.65846 90; 90.2288; 90 | 328.395 | Kennedy, Brendan J.; Howard, Christopher J.; Knight, Kevin S.; Zhang, Zhaoming; Zhou, Qingdi Structures and phase transitions in the ordered double perovskites Ba~2~Bi^III^Bi^V^O~6~ and Ba~2~Bi^III^Sb^V^O~6~ Acta Crystallographica Section B, 2006, 62, 537-546 |
| 2105382 | CIF | Ag8 S | I m m 2 | 5.9; 6.4; 8.7 90; 90; 90 | 328.512 | Hashimoto, H.; Yu, Y.-D.; Guan, R.; Makita, Y. Electron-microscope study of the structure of Ag8 S formed in the initial stage of silver sulfidation Acta Crystallographica B (39,1983-), 1995, 51, 149-155 |
| 9011159 | CIF | F3 La | P -3 c 1 | 7.185; 7.185; 7.351 90; 90; 120 | 328.648 | Cheetham, A. K.; Fender, B. E. F.; Fuess, H.; Wright, A. F. A powder neutron diffraction study of lanthanum and cerium trifluorides Chem 5 (1966) 1466-1468 Acta Crystallographica, Section B, 1976, 32, 94-97 |
| 9017319 | CIF | F3 La | P -3 c 1 | 7.185; 7.185; 7.351 90; 90; 120 | 328.648 | Zalkin, A.; Templeton, D. H. Refinement of the trigonal structure of lanthanum trifluoride with neutron diffraction data Note: neutron data Acta Crystallographica, Section B, 1985, 41, 91-93 |
| 2102777 | CIF Paper | Ba O9 V4 | P 1 2/c 1 | 7.6396; 4.9447; 9.3596 90; 111.427; 90 | 329.13 | Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G. Synthesis and structural characterization of BaV~4~O~9~ Acta Crystallographica Section B, 2007, 63, 270-276 |
| 2108753 | CIF HKL | C5 H11 Na O | P 4/n m m :2 | 4.4084; 4.4084; 16.9376 90; 90; 90 | 329.17 | Beske, Maurice; Cronje, Stephanie; Schmidt, Martin U.; Tapmeyer, Lukas Disordered sodium alkoxides from powder data: crystal structures of sodium ethoxide, propoxide, butoxide and pentoxide, and some of their solvates Acta Crystallographica Section B, 2021, 77 |
| 9015312 | CIF | As2 Ca H4 O8 | P -1 | 8.558; 7.697; 5.721 92.35; 109.52; 109.59 | 329.621 | Ferraris, G.; Jones, D. W.; Yerkess, J. A neutron diffraction study of the crystal structure of calcium bis(dihydrogen arsenate), Ca(H2AsO4)2 Acta Crystallographica, Section B, 1972, 28, 2430-2437 |
| 2106155 | CIF | Dy0.45 Gd0.55 Ni | P 1 21/m 1 | 14.35; 4.271; 5.468 90; 100.39; 90 | 329.632 | Klepp, K.; Parthe, E. Fe B - Cr B stacking variations of ternary rare earth-metal transition alloys in quasi-binary sections R1-x R'x Ni Acta Crystallographica B (24,1968-38,1982), 1980, 36, 774-782 |
| 2107076 | CIF | H10 N3 O2 P S | P -1 | 6.593; 6.972; 7.512 86.54; 73.14; 90.75 | 329.686 | Mootz, D.; Goldmann, J. Die Kristallstruktur von Diammonium-amidothiophosphat Acta Crystallographica B (24,1968-38,1982), 1969, 25, 1256-1262 |
| 2106975 | CIF | Li2 Sn5 | P 4/m b m | 10.274; 10.274; 3.125 90; 90; 90 | 329.86 | Hansen, D.A.; Chang, L.J. Crystal Structure of Li2 Sn5 Acta Crystallographica B (24,1968-38,1982), 1969, 25, 2392-2395 |
| 2106379 | CIF | Br O2 U | C m c m | 4.106; 20.2; 3.98 90; 90; 90 | 330.106 | Levet, J.C.; Potel, M. Structure Cristalline de U O2 Br Acta Crystallographica B (24,1968-38,1982), 1977, 33, 2542-2546 |
| 2104056 | CIF HKL Paper | S5 Sn Tb2 | P b a m | 7.717; 11.246; 3.8056 90; 90; 90 | 330.27 | Daszkiewicz, Marek; Gulay, Lubomir D.; Shemet, Vasylyna Ya. Crystal architecture of <i>R</i>~2~SnS~5~ (<i>R</i> = Pr, Nd, Gd and Tb): crystal structure relationships in chalcogenides Acta Crystallographica Section B, 2008, 64, 172-176 |
| 2102007 | CIF Paper | F Nb O2 | R -3 c | 5.3067; 5.3067; 13.5495 90; 90; 120 | 330.45 | Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E. High-pressure transformations of NbO~2~F Acta Crystallographica Section B, 2000, 56, 189-196 |
| 2104447 | CIF HKL Paper | Al1.778 Eu2 N14.222 O1.111 Si8.889 | Pm21n(\a00)000 | 4.899; 9.036; 7.4677 90; 90; 90 | 330.58 | Michiue, Yuichi; Shioi, Kousuke; Hirosaki, Naoto; Takeda, Takashi; Xie, Rong-Jun; Sato, Akira; Onoda, Mitsuko; Matsushita, Yoshitaka Eu~3~Si~15{-~<i>x</i>}Al~1+<i>x~</i>O~<i>x~</i>N~23{-~<i>x</i>} (<i>x</i> ≃5/3) as a commensurate composite crystal Acta Crystallographica Section B, 2009, 65, 567-575 |
| 9017295 | CIF | Ca Cl2 O4 | P -1 | 6.593; 6.364; 8.557 97.77; 93.52; 110.56 | 330.776 | Thewalt, U.; Bugg, C. E. Crystal structure of calcium chloride tetrahydrate Acta Crystallographica, Section B, 1973, 29, 615-617 |
| 2107079 | CIF | Al2 O5 Ti | B b m m | 9.481; 9.738; 3.583 90; 90; 90 | 330.804 | Morosin, B.; Lynch, R.W. Structure studies on Al2 Ti O5 at room temperature and at 600C Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1040-1046 |
| 9015889 | CIF | Ca Cl2 H8 O4 | P -1 | 6.5932; 6.3673; 8.5606 97.83; 93.5; 110.58 | 331.003 | Leclaire, A.; Borel, M. M. Liaisons hydrogene et coordination du calcium dans les cristaux de CaCl2*4H2O alpha Acta Crystallographica, Section B, 1979, 35, 585-588 |
| 2106544 | CIF | Ba3.82 F16 Zr2 | P 4/n m m :2 | 5.637; 5.637; 10.423 90; 90; 90 | 331.199 | Laval, J.P.; Frit, B. Etude Structurale d'une Phase Non Stoechiometrique Partiellement Desordonnee: Ba(4-Z) Zr(2+Z/2) F16 (0<Z<0.232) Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2533-2539 |
| 9007587 | CIF | O3 Sb2 | P c c n | 4.911; 12.464; 5.412 90; 90; 90 | 331.272 | Svensson, C. The crystal structure of orthorhombic antimony trioxide, Sb2O3 Acta Crystallographica, Section B, 1974, 30, 458-461 |
| 2100610 | CIF Paper | Al Ca Si | P -6 m 2 | 4.1772; 4.1772; 21.9372 90; 90; 120 | 331.5 | K. M. Sparta; R. Müller; M. Merz; G. Roth; P. Adelmann; T. Wolf Modulated corrugations in the crystal structure of the superconductor CaAlSi Acta Crystallographica, Section B, 2006, 62, 710-718 |
| 2109090 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.4335; 9.4863; 6.584 90; 102.191; 90 | 331.71 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2101176 | CIF Paper | Li Nb O3 | R 3 c :H | 5.2542; 5.2542; 13.8759 90; 90; 120 | 331.75 | Boysen, H.; Altorfer, F. A neutron powder investigation of the high-temperature structure and phase transition in LiNbO~3~ Acta Crystallographica Section B, 1994, 50, 405-414 |
| 2101181 | CIF Paper | Li Nb O3 | R 3 c :H | 5.2542; 5.2542; 13.8759 90; 90; 120 | 331.75 | Boysen, H.; Altorfer, F. A neutron powder investigation of the high-temperature structure and phase transition in LiNbO~3~ Acta Crystallographica Section B, 1994, 50, 405-414 |
| 2106290 | CIF | Ge Na2 O3 | C m c 21 | 10.845; 6.224; 4.918 90; 90; 90 | 331.961 | Cruickshank, D.W.J.; Kalman, A.; Stephens, J.S. A reinvestigation of sodium metagermanate Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1333-1334 |
| 2106419 | CIF | H4 O8 P2 Pb | P -1 | 9.029; 5.863; 7.815 96.92; 119.56; 104.92 | 332.306 | Prelesnik, B.; Herak, R.; Curic, M. Structure of lead bis(dihydrogenphosphate) Acta Crystallographica B (24,1968-38,1982), 1981, 37, 660-662 |
| 2102123 | CIF Paper | O5 Ta2 | C 1 2/c 1 | 12.7853; 4.8537; 5.5276 90; 104.264; 90 | 332.446 | Zibrov, I. P.; Filonenko, V. P.; Sundberg, M.; Werner, P.-E. Structures and phase transitions of <i>B</i>-Ta~2~O~5~ and <i>Z</i>-Ta~2~O~5~: two high-pressure forms of Ta~2~O~5~ Acta Crystallographica Section B, 2000, 56, 659-665 |
| 2103358 | CIF Paper | C2 H3 As N2 | P 32 2 1 | 8.1218; 8.1218; 5.8196 90; 90; 120 | 332.452 | Marsh, Richard E. The space groups of point group <i>C</i>~3~: some corrections, some comments Acta Crystallographica Section B, 2002, 58, 893-899 |
| 2103359 | CIF Paper | C14 H14 N2 O4 W | P 64 | 8.1218; 8.1218; 5.8196 90; 90; 120 | 332.452 | Marsh, Richard E. The space groups of point group <i>C</i>~3~: some corrections, some comments Acta Crystallographica Section B, 2002, 58, 893-899 |
| 2106908 | CIF | O4 S Sn | P n m a | 8.799; 5.319; 7.115 90; 90; 90 | 332.995 | Donaldson, J.D.; Puxley, D.C. The crystal structure of tin(II) sulfate Acta Crystallographica B (24,1968-38,1982), 1972, 28, 864-867 |
| 2107180 | CIF | Cl2 H2 I K O | P 1 21/m 1 | 8.022; 9.611; 4.354 90; 97.03; 90 | 333.167 | Soled, S.; Carpenter, G.B. The crystal structure of K I Cl2 and K I Cl2 H2 O Acta Crystallographica B (24,1968-38,1982), 1973, 29, 2104-2109 |
| 2105799 | CIF HKL Paper | K Pr S2 | R -3 m :H | 4.1925; 4.1925; 21.892 90; 90; 120 | 333.24 | Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series Acta Crystallographica Section B, 2014, 70, 360-371 |
| 2106981 | CIF | O8 U3 | A m m 2 | 4.136; 11.816; 6.822 90; 90; 90 | 333.398 | Herak, R. The Crystal Structure of the High Temperature Modification of U3 O8 Acta Crystallographica B (24,1968-38,1982), 1969, 25, 2505-2508 |
| 2106439 | CIF | H Na O4 S | P 1 21/n 1 | 8.759; 7.5; 5.147 90; 99.49; 90 | 333.492 | Sonneveld, E.J.; Visser, J.W. A new modification of sodium hydrogensulphate Acta Crystallographica B (24,1968-38,1982), 1978, 34, 643-645 |
| 2101058 | CIF Paper | C6 H4 N2 O4 | P 1 21/n 1 | 10.941; 5.3813; 5.6684 90; 92.116; 90 | 333.51 | Tonogaki, M.; Kawata, T.; Ohba, S.; Iwata, Y.; Shibuya, I. Electron-density distribution in crystals of <i>p</i>-nitrobenzene derivatives Acta Crystallographica Section B, 1993, 49, 1031-1039 |
| 9007508 | CIF | B F4 K | P n m a | 8.6588; 5.48; 7.0299 90; 90; 90 | 333.57 | Brunton, G. The crystal structure of KBF4 Acta Crystallographica, Section B, 1969, 25, 2161-2162 |
| 2101177 | CIF Paper | Li Nb O3 | R 3 c :H | 5.2718; 5.2718; 13.8604 90; 90; 120 | 333.6 | Boysen, H.; Altorfer, F. A neutron powder investigation of the high-temperature structure and phase transition in LiNbO~3~ Acta Crystallographica Section B, 1994, 50, 405-414 |
| 2101182 | CIF Paper | Li Nb O3 | R 3 c :H | 5.2719; 5.2719; 13.8601 90; 90; 120 | 333.6 | Boysen, H.; Altorfer, F. A neutron powder investigation of the high-temperature structure and phase transition in LiNbO~3~ Acta Crystallographica Section B, 1994, 50, 405-414 |
| 2105414 | CIF | B Co Nb | P m m n :2 | 3.266; 17.177; 5.947 90; 90; 90 | 333.627 | Shoemaker, D.P.; Kripyakevich, P.I.; Kuz'ma, Yu.B.; Brink-Shoemaker, C.; Voroshilov, Yu.V. The crystal structure of (Nb Co B) Acta Crystallographica B (24,1968-38,1982), 1971, 27, 257-261 |
| 2106872 | CIF | H6 K Na O6 Te | P 3 1 c | 6.55; 6.55; 8.98 90; 90; 120 | 333.649 | Daniel, F.; Moret, J.; Maurin, M.; Philippot, E. Etude du tellurite mixte de sodium et de potassium a trois molecules d'eau: Na K Te O3 (H2 O)3 Acta Crystallographica B (24,1968-38,1982), 1982, 38, 703-706 |
| 2104055 | CIF HKL Paper | Gd2 S5 Sn | P b a m | 7.733; 11.29; 3.8217 90; 90; 90 | 333.66 | Daszkiewicz, Marek; Gulay, Lubomir D.; Shemet, Vasylyna Ya. Crystal architecture of <i>R</i>~2~SnS~5~ (<i>R</i> = Pr, Nd, Gd and Tb): crystal structure relationships in chalcogenides Acta Crystallographica Section B, 2008, 64, 172-176 |
| 2107153 | CIF | Br Nd S | P 1 1 21/b | 6.94; 6.91; 7.05 90; 90; 99.28 | 333.661 | Savigny, N.; Adolphe, C.; Zalkin, A.; Templeton, D.H. Structure de Nd S Br et des sulfobromures de terres rares isotypes Acta Crystallographica B (24,1968-38,1982), 1973, 29, 1532-1535 |
| 2100604 | CIF HKL Paper | C10 H8 | P 1 21/a 1 | 7.9948; 5.8726; 8.542 90; 123.677; 90 | 333.74 | F. P. A. Fabbiani; D. R. Allan; S. Parsons; C. R. Pulham Exploration of the high-pressure behaviour of polycyclic aromatic hydrocarbons: naphthalene, phenanthrene and pyrene Acta Crystallographica Section B, 2006, 62, 826-842 |
| 2106941 | CIF | La O4 V | P 1 21/n 1 | 7.047; 7.286; 6.725 90; 104.85; 90 | 333.759 | Rice, C.E.; Robinson, W.R. Lanthanum orthovanadate Acta Crystallographica B (24,1968-38,1982), 1976, 32, 2232-2233 |
| 2107253 | CIF | Cu La S2 | P 1 21/c 1 | 8.849; 7.325; 6.938 90; 132.07; 90 | 333.835 | Julien-Pouzol, M.; Jaulmes, S.; Guittard, M.; Mazurier, A. Structure du disulfure de lanthane et de cuivre Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1901-1903 |
| 2105345 | CIF | Ag Mn O4 | P 1 21/n 1 | 5.64; 8.33; 7.12 90; 92.25; 90 | 334.248 | Boonstra, E.G. The crystal structure of silver permanganate Acta Crystallographica B (24,1968-38,1982), 1968, 24, 1053-1062 |
| 2100836 | CIF Paper | C18 H12 N2 O2 | P -1 | 3.817; 6.516; 13.531 93.11; 86.97; 95.02 | 334.36 | Mizuguchi, J.; Grubenmann, A.; Wooden, G.; Rihs, G. Structures of 3,6-diphenylpyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione and 2,5-dimethyl-3,6-diphenylpyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione Acta Crystallographica Section B, 1992, 48, 696-700 |
| 2105136 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.1142; 12.0534; 3.0574 90; 95.0321; 90 | 334.583 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2106291 | CIF | Cu16 O14.15 | I 41/a m d :2 | 5.817; 5.817; 9.893 90; 90; 90 | 334.754 | Datta, N.; Jeffery, J.W. The crystal structure of paramelaconite, (Cu2+)12 (Cu+)4 O14 Acta Crystallographica B (24,1968-38,1982), 1978, 34, 22-26 |
| 2101183 | CIF Paper | Li Nb O3 | R -3 c :H | 5.2849; 5.2849; 13.8481 90; 90; 120 | 334.96 | Boysen, H.; Altorfer, F. A neutron powder investigation of the high-temperature structure and phase transition in LiNbO~3~ Acta Crystallographica Section B, 1994, 50, 405-414 |
| 2101178 | CIF Paper | Li Nb O3 | R -3 c :H | 5.285; 5.285; 13.8488 90; 90; 120 | 334.99 | Boysen, H.; Altorfer, F. A neutron powder investigation of the high-temperature structure and phase transition in LiNbO~3~ Acta Crystallographica Section B, 1994, 50, 405-414 |
| 2106995 | CIF | Ba O3 Pr | P b n m | 6.181; 6.214; 8.722 90; 90; 90 | 335.001 | Jacobson, A.J.; Tofield, B.C.; Fender, B.E.F. The Structures of Ba Ce O3, Ba Pr O3 and Ba Tb O3 by neutron diffraction: Lattice parameter relations and ionic radii in O-Perovskites Acta Crystallographica B (24,1968-38,1982), 1972, 28, 956-961 |
| 2106383 | CIF | Cd H6 O7 P2 | P -1 | 6.772; 7.523; 7.982 113.7; 110.69; 95.26 | 335.126 | Loub, J.; Podlahova, J.; Jecny, J. The crystal structure of cadmium dihydrogenphosphite monohydrate Acta Crystallographica B (24,1968-38,1982), 1978, 34, 32-34 |
| 2105569 | CIF Paper | C8 H6 O3 | P 1 21 1 | 4.006; 11.489; 7.347 90; 97.5; 90 | 335.25 | Valente, E. J.; Fuller, J. F.; Ball, J. D. Pseudoacids. I. 4- and 5-Oxoacids Acta Crystallographica Section B, 1998, 54, 162-173 |
| 2104142 | CIF Paper | O9.84 S4 Sm4 Ti4 | I 4/m m m | 3.82123; 3.82123; 22.96371 90; 90; 90 | 335.311 | Yashima, Masatomo; Ogisu, Kiyonori; Domen, Kazunari Structure and electron density of oxysulfide Sm~2~Ti~2~S~2~O~4.9~, a visible-light-responsive photocatalyst Acta Crystallographica Section B, 2008, 64, 291-298 |
| 2101184 | CIF Paper | Li Nb O3 | R -3 c :H | 5.2897; 5.2897; 13.8476 90; 90; 120 | 335.56 | Boysen, H.; Altorfer, F. A neutron powder investigation of the high-temperature structure and phase transition in LiNbO~3~ Acta Crystallographica Section B, 1994, 50, 405-414 |
| 2101179 | CIF Paper | Li Nb O3 | R -3 c :H | 5.2898; 5.2898; 13.8485 90; 90; 120 | 335.59 | Boysen, H.; Altorfer, F. A neutron powder investigation of the high-temperature structure and phase transition in LiNbO~3~ Acta Crystallographica Section B, 1994, 50, 405-414 |
| 2101185 | CIF Paper | Li Nb O3 | R -3 c :H | 5.292; 5.292; 13.845 90; 90; 120 | 335.79 | Boysen, H.; Altorfer, F. A neutron powder investigation of the high-temperature structure and phase transition in LiNbO~3~ Acta Crystallographica Section B, 1994, 50, 405-414 |
| 2101180 | CIF Paper | Li Nb O3 | R -3 c :H | 5.292; 5.292; 13.846 90; 90; 120 | 335.81 | Boysen, H.; Altorfer, F. A neutron powder investigation of the high-temperature structure and phase transition in LiNbO~3~ Acta Crystallographica Section B, 1994, 50, 405-414 |
| 2106645 | CIF Paper | Ba0.56 Ce0.886 O3 Pr0.44 | P n m a | 6.18949; 8.74009; 6.21421 90; 90; 90 | 336.168 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106646 | CIF Paper | Ba0.56 Ce0.886 O3 Pr0.44 | P n m a | 6.18949; 8.74009; 6.21421 90; 90; 90 | 336.168 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106647 | CIF Paper | Ba Ce0.2 O3 Pr0.8 | P n m a | 6.18949; 8.74009; 6.21421 90; 90; 90 | 336.168 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106648 | CIF Paper | Ba Ce0.2 O3 Pr0.8 | P n m a | 6.18949; 8.74009; 6.21421 90; 90; 90 | 336.168 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106649 | CIF Paper | Ba0.99 Ce0.2 O3 Pr0.79 | P n m a | 6.18949; 8.74009; 6.21421 90; 90; 90 | 336.168 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106650 | CIF Paper | Ba0.99 Ce0.2 O3 Pr0.79 | P n m a | 6.18949; 8.74009; 6.21421 90; 90; 90 | 336.168 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2108132 | CIF HKL | C7 H6 O2 S | P -1 | 3.863; 6.0337; 14.4721 91.302; 93.062; 92.925 | 336.29 | Pavan, Mysore. S; Sarkar, Sounak; Row, Tayur N. Guru Exploring the rare S—H···S hydrogen bond using charge density analysis in isomers of mercaptobenzoic acid Acta Crystallographica Section B, 2017, 73, 626-633 |
| 2022901 | CIF HKL Paper | B3 Ca H7 O9 | P -1 | 6.55; 8.2005; 6.4337 90.367; 102.63; 86.784 | 336.68 | Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite) Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945 |
| 2107061 | CIF | Ba O3 Pu | P b n m | 6.219; 6.193; 8.744 90; 90; 90 | 336.769 | Christoph, G.G.; Larson, A.C.; Eller, P.G.; Purson, J.D.; Zahrt, J.D.; Rinehart, G.H.; Penneman, R.A. Structure of barium plutonate by neutron powder diffraction Acta Crystallographica B (39,1983-), 1988, 44, 575-580 |
| 2103096 | CIF Paper | Cl2 H8 Mg O4 | P 1 21/c 1 | 5.9001; 7.2709; 8.4199 90; 111.007; 90 | 337.2 | Kaduk, James A. Use of the Inorganic Crystal Structure Database as a problem solving tool Acta Crystallographica, Section B: Structural Science, 2002, 58, 370-379 |
| 2106639 | CIF Paper | Ba0.625 Ce0.9 O3 Pr0.375 | P n m a | 6.19647; 8.74999; 6.22045 90; 90; 90 | 337.267 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106640 | CIF Paper | Ba0.625 Ce0.9 O3 Pr0.375 | P n m a | 6.19647; 8.74999; 6.22045 90; 90; 90 | 337.267 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106641 | CIF Paper | Ba Ce0.4 O3 Pr0.6 | P n m a | 6.19647; 8.74999; 6.22045 90; 90; 90 | 337.267 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106642 | CIF Paper | Ba Ce0.4 O3 Pr0.6 | P n m a | 6.19647; 8.74999; 6.22045 90; 90; 90 | 337.267 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106643 | CIF Paper | Ba0.991 Ce0.396 O3 Pr0.594 | P n m a | 6.19647; 8.74999; 6.22045 90; 90; 90 | 337.267 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106644 | CIF Paper | Ba0.991 Ce0.396 O3 Pr0.594 | P n m a | 6.19647; 8.74999; 6.22045 90; 90; 90 | 337.267 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106308 | CIF | As Ca H O4 | P -1 | 7.0591; 6.8906; 7.2006 97.43; 103.55; 87.75 | 337.625 | Ferraris, G.; Chiari, G. The crystal structure of Ca H As O4 (weilite) Acta Crystallographica B (24,1968-38,1982), 1970, 26, 403-409 |
| 9007511 | CIF | As2 Ca2 H2 O8 | P -1 | 7.0591; 6.8906; 7.2006 97.43; 103.55; 87.75 | 337.625 | Ferraris, G.; Chiari, G. The crystal structure of CaHAsO4 (weilite) Acta Crystallographica, Section B, 1970, 26, 403-409 |
| 2100603 | CIF HKL Paper | C10 H8 | P 1 21/a 1 | 8.0348; 5.8899; 8.565 90; 123.59; 90 | 337.65 | F. P. A. Fabbiani; D. R. Allan; S. Parsons; C. R. Pulham Exploration of the high-pressure behaviour of polycyclic aromatic hydrocarbons: naphthalene, phenanthrene and pyrene Acta Crystallographica Section B, 2006, 62, 826-842 |
| 2104392 | CIF HKL Paper | B Be2 F2 O3 Rb | R 3 2 :H | 4.4387; 4.4387; 19.82 90; 90; 120 | 338.18 | McMillen, Colin D.; Hu, Jia; VanDerveer, Donald; Kolis, Joseph W. Trigonal structures of <i>A</i>Be~2~BO~3~F~2~ (<i>A</i> = Rb, Cs, Tl) crystals Acta Crystallographica Section B, 2009, 65, 445-449 |
| 2106633 | CIF Paper | Ba0.71 Ce0.92 O3 Pr0.29 | P n m a | 6.20345; 8.75952; 6.22537 90; 90; 90 | 338.282 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106634 | CIF Paper | Ba0.71 Ce0.92 O3 Pr0.29 | P n m a | 6.20345; 8.75952; 6.22537 90; 90; 90 | 338.282 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106635 | CIF Paper | Ba Ce0.6 O3 Pr0.4 | P n m a | 6.20345; 8.75952; 6.22537 90; 90; 90 | 338.282 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106636 | CIF Paper | Ba Ce0.6 O3 Pr0.4 | P n m a | 6.20345; 8.75952; 6.22537 90; 90; 90 | 338.282 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106637 | CIF Paper | Ba0.995 Ce0.597 O3 Pr0.4 | P n m a | 6.20345; 8.75952; 6.22537 90; 90; 90 | 338.282 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106638 | CIF Paper | Ba0.995 Ce0.597 O3 Pr0.4 | P n m a | 6.20345; 8.75952; 6.22537 90; 90; 90 | 338.282 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2105385 | CIF | Ag3 Te2 Tl | C m m m | 4.6; 15.45; 4.76 90; 90; 90 | 338.293 | Gelato, L.M.; Penzo, M.; Parthe, E.; Cenzual, K. Inorganic structure types with revised space groups.I. Acta Crystallographica B (39,1983-), 1991, 47, 433-439 |
| 2106247 | CIF | H2 O9 S2 Zr | P -1 | 7.89; 5.21; 8.96 95.2; 99.8; 109.2 | 338.475 | Bear, I.J.; Mumme, W.G. The crystal chemistry of zirconium sulphates. IV. The structure of the gamma-monohydrate Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1125-1131 |
| 2101597 | CIF Paper | Ag S2 Yb | I 41 m d | 5.356; 5.356; 11.803 90; 90; 90 | 338.59 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2104129 | CIF Paper | La Ni O3 | R -3 c | 5.4561; 5.4561; 13.1432 90; 90; 120 | 338.841 | Yang, J. Structural analysis of perovskite LaCr~1{-~<i>x</i>}Ni~<i>x~</i>O~3~ by Rietveld refinement of X-ray powder diffraction data Acta Crystallographica Section B, 2008, 64, 281-286 |
| 2100898 | CIF Paper | H O4 Rb Se | P 1 | 10.622; 4.622; 7.575 89.35; 110.84; 102.13 | 339 | Makarova, I. P. Thermal vibrations of atoms and phase transition in RbHSeO~4~ and NH~4~HSeO~4~ single crystals Acta Crystallographica Section B, 1993, 49, 11-18 |
| 2109089 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.4696; 9.5403; 6.6492 90; 102.28; 90 | 339.03 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 9011322 | CIF | Cl H6 Mg0.5 O2 | C m c m | 4.21616; 11.023; 7.2951 90; 90; 90 | 339.038 | Sugimoto, K.; Dinnebier, R. E.; Hanson, J. C. Structures of three dehydration products of bischofite from in situ synchrotron powder diffraction data (MgCl2*nH2O; n = 1,2,4) Acta Crystallographica, Section B, 2007, 63, 235-242 |
| 2102789 | CIF HKL Paper | Cl2 H8 Mg O4 | C m c m | 4.21616; 11.023; 7.2951 90; 90; 90 | 339.04 | Sugimoto, Kunihisa; E. Dinnebier, Robert; Jonathan C. Hanson Structures of three dehydration products of bischofite from <i>in situ</i> synchrotron powder diffraction data (MgCl~2~·<i>n</i>H~2~O; <i>n</i> = 1, 2, 4) Acta Crystallographica Section B, 2007, 63, 235-242 |
| 2106301 | CIF | Ce Cr O S2 | B 1 1 2/m | 11.518; 7.951; 3.703 90; 90; 90.07 | 339.119 | Dugue, J.; Villers, J.; Vovan, T. Etude Structurale des Oxysulfures de Chrome(III) et de Terres Rares. II. Structure de l'Oxysulfure Ce Cr O S2 Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1294-1297 |
| 2106627 | CIF Paper | Ba0.83 Ce0.95 O3 Pr0.17 | P n m a | 6.21025; 8.76826; 6.22886 90; 90; 90 | 339.181 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106628 | CIF Paper | Ba0.83 Ce0.95 O3 Pr0.17 | P n m a | 6.21025; 8.76826; 6.22886 90; 90; 90 | 339.181 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106629 | CIF Paper | Ba Ce0.8 O3 Pr0.2 | P n m a | 6.21025; 8.76826; 6.22886 90; 90; 90 | 339.181 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106630 | CIF Paper | Ba Ce0.8 O3 Pr0.2 | P n m a | 6.21025; 8.76826; 6.22886 90; 90; 90 | 339.181 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106631 | CIF Paper | Ba Ce0.8 O3 Pr0.2 | P n m a | 6.21025; 8.76826; 6.22886 90; 90; 90 | 339.181 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106632 | CIF Paper | Ba Ce0.8 O3 Pr0.2 | P n m a | 6.21025; 8.76826; 6.22886 90; 90; 90 | 339.181 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2105135 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.1834; 12.0234; 3.0886 90; 95.7294; 90 | 339.326 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2107125 | CIF | Se2 Si | I b a m | 9.669; 5.998; 5.851 90; 90; 90 | 339.327 | Peters, J.; Krebs, B. Silicon disulphide and silicon diselenide: A reinvestigation Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1270-1272 |
| 2105209 | CIF Paper | C5 H12 O5 | P 1 | 7.67982; 9.717; 4.82857 96.0388; 106.806; 96.094 | 339.478 | Derollez, Patrick; Guinet, Yannick; Affouard, Frédéric; Danède, Florence; Carpentier, Laurent; Hédoux, Alain Structure determination of <small>L</small>-arabinitol by powder X-ray diffraction Acta Crystallographica Section B, 2012, 68, 407-411 |
| 2102530 | CIF Paper | C7 H9 N O2 | P 1 21/m 1 | 7.11; 6.993; 7.678 90; 117.04; 90 | 340 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2003120 | CIF Paper | As F6 K | R -3 :H | 7.348; 7.348; 7.274 90; 90; 120 | 340.1 | Peterková, J.; Dusek, M.; Petrícek, V.; Loub, J. Structures of Fluoroarsenates KAsF~6<i>n~</i>(OH)~<i>n~</i>, <i>n</i> = 0, 1, 2: Application of the Heavy-Atom Method for Modulated Structures Acta Crystallographica Section B, 1998, 54, 809-818 |
| 2106994 | CIF | Ba Ce O3 | P b n m | 6.212; 6.235; 8.781 90; 90; 90 | 340.104 | Jacobson, A.J.; Tofield, B.C.; Fender, B.E.F. The structures of Ba Ce O3, Ba Pr O3 and Ba Tb O3 by neutron diffraction: Lattice parameter relations and ionic radii in O-Perovskites Acta Crystallographica B (24,1968-38,1982), 1972, 28, 956-961 |
| 2104391 | CIF HKL Paper | B Be2 F2 O3 Tl | R 3 2 :H | 4.4387; 4.4387; 19.942 90; 90; 120 | 340.26 | McMillen, Colin D.; Hu, Jia; VanDerveer, Donald; Kolis, Joseph W. Trigonal structures of <i>A</i>Be~2~BO~3~F~2~ (<i>A</i> = Rb, Cs, Tl) crystals Acta Crystallographica Section B, 2009, 65, 445-449 |
| 2106357 | CIF | I Na O4 | I 41/a :1 | 5.337; 5.337; 11.947 90; 90; 90 | 340.293 | Kalman, A.; Cruickshank, D.W.J. Refinement of the Structure of Na I O4 Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1782-1785 |
| 2106625 | CIF Paper | Ba Ce O3 | P n m a | 6.21664; 8.77789; 6.23629 90; 90; 90 | 340.308 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106626 | CIF Paper | Ba Ce O3 | P n m a | 6.21664; 8.77789; 6.23629 90; 90; 90 | 340.308 | Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V. Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ} Acta Crystallographica Section B, 2015, 71, 455-462 |
| 2106913 | CIF | C4 Al0.84 B39.82 | R -3 m :H | 5.642; 5.642; 12.367 90; 90; 120 | 340.927 | Neidhard, H.; Mattes, R.; Becher, H.J. Zur Darstellung und Struktur eines aluminiumhaltigen Borcarbids Acta Crystallographica B (24,1968-38,1982), 1970, 26, 315-317 |
| 2109076 | CIF | Al0.1 B Fe0.45 Mg2.15 O5 Ti0.3 | P b a m | 9.246; 12.2731; 3.0092 90; 90; 90 | 341.48 | Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Levashova, Irina O.; Shablinskii, Andrey P.; Cherosov, Mikhail A.; Bubnova, Rimma S.; Vagizov, Farit G.; Krzhizhanovskaya, Maria G.; Filatov, Stanislav K.; Shilovskikh, Vladimir V.; Pekov, Igor V. X-ray diffraction and Mössbauer spectroscopy study of oxoborate azoproite (Mg,Fe^2+^)~2~(Fe^3+^,Ti,Mg,Al)O~2~(BO~3~): an <i>in situ</i> temperature-dependent investigation (5 {łeq} <i>T</i> {łeq} 1650K) Acta Crystallographica Section B, 2022, 78 |
| 2106435 | CIF | Ba5 O15 Ta4 | P -3 m 1 | 5.776; 5.776; 11.82 90; 90; 120 | 341.509 | Shannon, J.; Katz, L. A Refinement of the structure of barium tantalum oxide, Ba5 Ta4 O15 Acta Crystallographica B (24,1968-38,1982), 1970, 26, 102-105 |
| 2102117 | CIF Paper | H2 O8 P2 Zr | P n n m | 8.1935; 7.709; 5.408 90; 90; 90 | 341.59 | Krogh Andersen, Anne Marie; Norby, Poul <i>Ab initio</i> structure determination and Rietveld refinement of a high-temperature phase of zirconium hydrogen phosphate and a new polymorph of zirconium pyrophosphate from <i>in situ</i> temperature-resolved powder diffraction data Acta Crystallographica Section B, 2000, 56, 618-625 |
| 2105387 | CIF | Au Cl O | R -3 :R | 8.148; 8.148; 8.148 113.45; 113.45; 113.45 | 341.64 | Rumpel, H.; Schwarzmann, E.; Jones, P.G.; Sheldrick, G.M. Gold(III) chloride oxide Acta Crystallographica B (24,1968-38,1982), 1979, 35, 2380-2381 |
| 2103682 | CIF Paper | C8 H2 Cl4 K2 O8 | P 1 | 5.022; 7.827; 8.838 80.99; 85.13; 88.95 | 341.9 | Olovsson, I.; Ptasiewicz-Bak, H.; Gustafsson, T.; Majerz, I. Asymmetric hydrogen bonds in centrosymmetric environment: neutron study of very short hydrogen bonds in potassium hydrogen dichloromaleate Acta Crystallographica Section B, 2001, 57, 311-316 |
| 2107008 | CIF | K O3 P | P b n m | 12.8; 4.54; 5.89 90; 90; 90 | 342.28 | Jost, K.H.; Schulze, H.J. Zur Phasentransformation des Kaliumpolyphosphates (K P O3)x Acta Crystallographica B (24,1968-38,1982), 1969, 25, 1110-1118 |
| 2104054 | CIF HKL Paper | Nd2 S5 Sn | P b a m | 7.7721; 11.218; 3.9272 90; 90; 90 | 342.4 | Daszkiewicz, Marek; Gulay, Lubomir D.; Shemet, Vasylyna Ya. Crystal architecture of <i>R</i>~2~SnS~5~ (<i>R</i> = Pr, Nd, Gd and Tb): crystal structure relationships in chalcogenides Acta Crystallographica Section B, 2008, 64, 172-176 |
| 2103333 | CIF Paper | C8 H2 Cl4 K2 O8 | P 1 | 5.031; 7.827; 8.835 81.24; 85.17; 89.16 | 342.6 | Olovsson, I.; Ptasiewicz-Bak, H.; Gustafsson, T.; Majerz, I. Asymmetric hydrogen bonds in centrosymmetric environment. II. Neutron study of very short hydrogen bonds in potassium hydrogen dichloromaleate at 90K and 170K Acta Crystallographica Section B, 2002, 58, 627-631 |
| 2104128 | CIF Paper | Cr0.1 La Ni0.9 O3 | R -3 c | 5.4747; 5.4747; 13.199 90; 90; 120 | 342.6 | Yang, J. Structural analysis of perovskite LaCr~1{-~<i>x</i>}Ni~<i>x~</i>O~3~ by Rietveld refinement of X-ray powder diffraction data Acta Crystallographica Section B, 2008, 64, 281-286 |
| 2101344 | CIF Paper | Ca Mg O4 Si | P n m a | 11.1098; 6.3894; 4.8281 90; 90; 90 | 342.72 | Pilati, T.; Demartin, F.; Gramaccioli, C. M. Thermal parameters for minerals of the olivine group: their implication on vibrational spectra, thermodynamic functions and transferable force fields Acta Crystallographica Section B, 1995, 51, 721-733 |
| 9016495 | CIF | Ca Fe0.12 Mg0.88 O4 Si | P n m a | 11.1098; 6.3894; 4.8281 90; 90; 90 | 342.722 | Pilati, T.; Demartin, F.; Gramaccioli, C. M. Thermal parameters for minerals of the olivine group: their implication on vibrational spectra, thermodynamic functions and transferable force fields Acta Crystallographica, Section B, 1995, 51, 721-733 |
| 2101671 | CIF Paper | Al2 O5 Si | P n n m | 7.7992; 7.905; 5.5591 90; 90; 90 | 342.73 | Pilati, T.; Demartin, F.; Gramaccioli, C. M. Transferability of Empirical Force Fields in Silicates: Lattice-Dynamical Evaluation of Atomic Displacement Parameters and Thermodynamic Properties for the Al~2~OSiO~4~ Polymorphs Acta Crystallographica Section B, 1997, 53, 82-94 |
| 2105141 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.2295; 12.0064; 3.1155 90; 96.3516; 90 | 343.119 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2104418 | CIF HKL Paper | As2 Au Ce | P21/m(\a0\g)00 | 5.804; 5.814; 10.179 90; 90.09; 90 | 343.484 | Rutzinger, D.; Doert, Th.; Ruck, M. Incommensurately modulated lanthanide coinage-metal diarsenides. I. CeAu~1{-~δ}As~2~ [δ = 0.015(2)] ‒ a new distortion variant of the HfCuSi~2~ type with irregularly stacked <i>cis</i>‒<i>trans</i> chains of arsenic atoms Acta Crystallographica Section B, 2009, 65, 519-526 |
| 2105134 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.2363; 11.9873; 3.1205 90; 96.1667; 90 | 343.497 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2104127 | CIF Paper | Cr0.2 La Ni0.8 O3 | R -3 c | 5.4809; 5.4809; 13.207 90; 90; 120 | 343.59 | Yang, J. Structural analysis of perovskite LaCr~1{-~<i>x</i>}Ni~<i>x~</i>O~3~ by Rietveld refinement of X-ray powder diffraction data Acta Crystallographica Section B, 2008, 64, 281-286 |
| 2104126 | CIF Paper | Cr0.3 La Ni0.7 O3 | R -3 c | 5.4831; 5.4831; 13.2091 90; 90; 120 | 343.919 | Yang, J. Structural analysis of perovskite LaCr~1{-~<i>x</i>}Ni~<i>x~</i>O~3~ by Rietveld refinement of X-ray powder diffraction data Acta Crystallographica Section B, 2008, 64, 281-286 |
| 2003111 | CIF Paper | Al2 F2 O4 Si | P b n m | 4.6511; 8.802; 8.402 90; 90; 90 | 343.97 | Ivanov, Yu.V.; Belokoneva, E.L.; Protas, J.; Hansen, N.K.; Tsirelson, V.G. Multipole Analysis of the Electron Density in Topaz Using X-ray Diffraction Data Acta Crystallographica Section B, 1998, 54, 774-781 |
| 9007652 | CIF | Fe S | P -6 2 c | 5.861; 5.861; 11.577 90; 90; 120 | 344.406 | King, Jr, H. E.; Prewitt, C. T. High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 3.33 GPa Acta Crystallographica, Section B, 1982, 38, 1877-1887 |
| 2312283 | CIF | Al0.08 B Fe1.183 Mg1.737 O5 | P b a m | 9.2532; 12.3025; 3.0256 90; 90; 90 | 344.43 | Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Levashova, Irina O.; Shablinskii, Andrey P.; Bubnova, Rimma S.; Vagizov, Farit G.; Ugolkov, Valery L.; Filatov, Stanislav K.; Pekov, Igor V. Crystal structure refinement, low- and high-temperature X-ray diffraction and Mössbauer spectroscopy study of the oxoborate ludwigite from the Iten'yurginskoe deposit. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312425 | CIF | Ca8 O16 Si4 | P n m a | 6.776; 5.496; 9.252 90; 90; 90 | 344.553 | Plana-Ruiz, Sergi; Götz, Emilia; Neumann, Thomas; Schwesig, Peter; Kolb, Ute Three-dimensional electron diffraction on clinkers: the belite α'<sub>H</sub> incommensurate modulated structure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 105-116 |
| 2312426 | CIF | Ca8 O16 Si4 | P n m a | 6.776; 5.496; 9.252 90; 90; 90 | 344.553 | Plana-Ruiz, Sergi; Götz, Emilia; Neumann, Thomas; Schwesig, Peter; Kolb, Ute Three-dimensional electron diffraction on clinkers: the belite α'<sub>H</sub> incommensurate modulated structure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 105-116 |
| 2103332 | CIF Paper | C8 H2 Cl4 K2 O8 | P 1 | 5.048; 7.84; 8.839 81.46; 85.05; 89.35 | 344.6 | Olovsson, I.; Ptasiewicz-Bak, H.; Gustafsson, T.; Majerz, I. Asymmetric hydrogen bonds in centrosymmetric environment. II. Neutron study of very short hydrogen bonds in potassium hydrogen dichloromaleate at 90K and 170K Acta Crystallographica Section B, 2002, 58, 627-631 |
| 2108280 | CIF HKL | C10 H8 | P 1 21/a 1 | 7.7154; 5.9019; 7.6969 90; 100.411; 90 | 344.712 | Dittrich, B.; Fabbiani, F. P. A.; Henn, J.; Schmidt, M. U.; Macchi, P.; Meindl, K.; Spackman, M. A. Azulene revisited: solid-state structure, invariom modeling and lattice-energy minimization of a classical example of disorder Acta Crystallographica Section B, 2018, 74 |
| 2312427 | CIF | Ca8 O16 Si4 | P n m a | 6.765; 5.514; 9.25 90; 90; 90 | 345.045 | Plana-Ruiz, Sergi; Götz, Emilia; Neumann, Thomas; Schwesig, Peter; Kolb, Ute Three-dimensional electron diffraction on clinkers: the belite α'<sub>H</sub> incommensurate modulated structure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 105-116 |
| 2312428 | CIF | Ca8 O16 Si4 | P n m a | 6.765; 5.514; 9.25 90; 90; 90 | 345.045 | Plana-Ruiz, Sergi; Götz, Emilia; Neumann, Thomas; Schwesig, Peter; Kolb, Ute Three-dimensional electron diffraction on clinkers: the belite α'<sub>H</sub> incommensurate modulated structure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 105-116 |
| 2104095 | CIF Paper | K Mo2 O8 Sm | I2/b(\a\b0)00 | 5.5279; 5.2994; 11.7841 90; 90; 91.1388 | 345.142 | Arakcheeva, Alla; Pattison, Philip; Chapuis, Gervais; Rossell, Marta; Filaretov, Andrey; Morozov, Vladimir; Van Tendeloo, Gustaaf KSm(MoO~4~)~2~, an incommensurately modulated and partially disordered scheelite-like structure Acta Crystallographica Section B, 2008, 64, 160-171 |
| 2105400 | CIF | B2 Eu O4 | P n c a | 6.593; 12.063; 4.343 90; 90; 90 | 345.405 | Adachi, G.Y.; Shiokawa, J.; Machida, K. Structure of Divalent-Europium Metaborate Acta Crystallographica B (24,1968-38,1982), 1979, 35, 149-151 |
| 2104771 | CIF HKL Paper | Bi2 Ga4 O9 | P b a m | 7.4596; 8.058; 5.747 90; 90; 90 | 345.45 | Friedrich, Alexandra; Juarez-Arellano, Erick A.; Haussühl, Eiken; Boehler, Reinhard; Winkler, Björn; Wiehl, Leonore; Morgenroth, Wolfgang; Burianek, Manfred; Mühlberg, Manfred Persistence of the stereochemical activity of the Bi^3+^ lone electron pair in Bi~2~Ga~4~O~9~ up to 50GPa and crystal structure of the high-pressure phase Acta Crystallographica Section B, 2010, 66, 323-337 |
| 2105798 | CIF HKL Paper | K La S2 | R -3 m :H | 4.2651; 4.2651; 21.929 90; 90; 120 | 345.47 | Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series Acta Crystallographica Section B, 2014, 70, 360-371 |
| 2104053 | CIF HKL Paper | Pr2 S5 Sn | P b a m | 7.8195; 11.2145; 3.9462 90; 90; 90 | 346.05 | Daszkiewicz, Marek; Gulay, Lubomir D.; Shemet, Vasylyna Ya. Crystal architecture of <i>R</i>~2~SnS~5~ (<i>R</i> = Pr, Nd, Gd and Tb): crystal structure relationships in chalcogenides Acta Crystallographica Section B, 2008, 64, 172-176 |
| 2104448 | CIF Paper | Ba F4 Mg | C m c 21 | 4.11899; 14.4626; 5.81151 90; 90; 90 | 346.199 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2104454 | CIF HKL Paper | Ba F4 Mg | C m c 21 | 4.11886; 14.4761; 5.81296 90; 90; 90 | 346.598 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2104790 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.5441; 5.4007; 11.587 90; 90; 90 | 346.94 | Tumanov, N. A.; Boldyreva, E. V.; Kolesov, B. A.; Kurnosov, A. V.; Quesada Cabrera, R. Pressure-induced phase transitions in <small>L</small>-alanine, revisited Acta Crystallographica Section B, 2010, 66, 458-471 |
| 2102119 | CIF Paper | C6 H13 N O2 | P -1 | 5.2289; 5.4102; 13.1095 96.332; 90.622; 109.493 | 347.02 | Dalhus, Bjørn; Görbitz, Carl Henrik Structural relationships in crystals accommodating different stereoisomers of 2-amino-3-methylpentanoic acid Acta Crystallographica Section B, 2000, 56, 720-727 |
| 2104453 | CIF HKL Paper | Ba F4 Mg | C m c 21 | 4.12099; 14.48798; 5.81496 90; 90; 90 | 347.181 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2106845 | CIF | Ca O9 V4 | P 4/n :2 | 8.333; 8.333; 5.008 90; 90; 90 | 347.75 | Bouloux, J.C.; Galy, J. Structure cristalline de l'hypovanadate Ca V4 O9 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 1335-1338 |
| 2106068 | CIF | K O3 P | B b m m | 12.94; 4.54; 5.92 90; 90; 90 | 347.786 | Jost, K.H.; Schulze, H.J. Mechanismen der Phasentransformation des K (P O3) und die Struktur der Hoechsttemperatur Modifikation des K (P O3) Acta Crystallographica B (24,1968-38,1982), 1971, 27, 1345-1353 |
| 2104452 | CIF HKL Paper | Ba F4 Mg | C m c 21 | 4.12398; 14.50096; 5.81748 90; 90; 90 | 347.895 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2106302 | CIF | Cr La O S2 | P b n m | 11.193; 8.398; 3.704 90; 90; 90 | 348.172 | Dugue, J.; Vovan, T.; Villers, J. Etude Structurale des Oxysulfures de Chrome(III) et de Terres Rares. I. Structure de l'Oxysulfure La Cr O S2 Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1291-1294 |
| 1007053 | CIF | As4 Cd H10 O16 | P -1 | 5.69; 7.42; 8.6 105.17; 95.13; 91.85 | 348.4 | Boudjada, A; Durif, A; Guitel, J C Structure d'un Orthoarsenate Acide de Cadmium: Cd H~10~ (As O~4~)~4~ Acta Crystallographica B (24,1968-38,1982), 1980, 36, 133-135 |
| 2106695 | CIF | Ba S2 | C 1 2/c 1 | 9.299; 4.736; 8.993 90; 118.37; 90 | 348.485 | Kawada, I.; Yamaoka, S.; Kato, K. Barium disulphide Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2905-2906 |
| 2104451 | CIF HKL Paper | Ba F4 Mg | C m c 21 | 4.12743; 14.51455; 5.82028 90; 90; 90 | 348.68 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2107207 | CIF | Ge0.5 Li3.5 O4 V0.5 | P n m a | 10.8714; 6.2606; 5.1258 90; 90; 90 | 348.87 | Abrahams, I.; Bruce, P.G. Defect clustering in the superionic conductor lithium germanium vanadate Acta Crystallographica B (39,1983-), 1991, 47, 696-701 |
| 2105133 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.3174; 11.9774; 3.1597 90; 97.1782; 90 | 349.853 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2103681 | CIF Paper | C8 H2 Cl4 K2 O8 | P 1 | 5.083; 7.881; 8.863 81.72; 84.78; 89.59 | 349.9 | Olovsson, I.; Ptasiewicz-Bak, H.; Gustafsson, T.; Majerz, I. Asymmetric hydrogen bonds in centrosymmetric environment: neutron study of very short hydrogen bonds in potassium hydrogen dichloromaleate Acta Crystallographica Section B, 2001, 57, 311-316 |
| 2106292 | CIF | Be F4 Na2 | P 1 21/n 1 | 5.559; 8.0703; 7.9098 90; 99.35; 90 | 350.141 | Deganello, S. The crystal structure of - gamma-sodium beryllium tetrafluoride, Na2 Be F4 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 2593-2598 |
| 1000157 | CIF | Cr F6 Mn Na | P 3 2 1 | 8.993; 8.993; 5.003 90; 90; 120 | 350.4 | Courbion, G; Jacoboni, C; de Pape, R La structure cristalline de Na Mn Cr F~6~ Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1405-1408 |
| 2100595 | CIF Paper | C3 D7 N O3 | P 21 21 21 | 6.5477; 9.5405; 5.6092 90; 90; 90 | 350.4 | S. A. Moggach; W. G. Marshall; S. Parsons High-pressure neutron diffraction study of L-serine-I and L-serine-II, and the structure of L-serine-III at 8.1 GPa Acta Crystallographica, Section B, 2006, 62, 815-825 |
| 2022900 | CIF HKL Paper | B3 Ca H7 O9 | P -1 | 6.639; 8.3489; 6.4786 90.77; 101.94; 86.747 | 350.76 | Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite) Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945 |
| 2106552 | CIF | In Se | R 3 m :H | 4; 4; 25.32 90; 90; 120 | 350.844 | Likforman, A.; Carre, D.; Bachet, J.E.; Bachet, B. Structure cristalline du monoseleniure d'indium In Se Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1252-1254 |
| 2107205 | CIF | Ge Li3 O4 Zn0.5 | P n m a | 10.8523; 6.27431; 5.15807 90; 90; 90 | 351.217 | Abrahams, I.; Bruce, P.G.; David, W.I.F.; West, A.R. A re-examination of the lisicon structure using highresolution powder neutron diffraction: Evidence for defect clustering Acta Crystallographica B (39,1983-), 1989, 45, 457-462 |
| 2102120 | CIF Paper | C6 H13 N O2 | P 1 | 5.2438; 5.3978; 13.2562 93.042; 92.811; 109.897 | 351.42 | Dalhus, Bjørn; Görbitz, Carl Henrik Structural relationships in crystals accommodating different stereoisomers of 2-amino-3-methylpentanoic acid Acta Crystallographica Section B, 2000, 56, 720-727 |
| 2104976 | CIF HKL Paper | C7 H4 Cl2 O | P 1 21 1 | 3.8094; 14.8887; 6.2014 90; 91.849; 90 | 351.54 | Solanko, Katarzyna A.; Bond, Andrew D. Intermolecular interactions and unexpected isostructurality in the crystal structures of the dichlorobenzaldehyde isomers Acta Crystallographica Section B, 2011, 67, 437-445 |
| 2107319 | CIF | Na2 O4 S | C m c m | 5.6274; 8.9664; 6.9737 90; 90; 90 | 351.876 | Tanaka, K.; Naruse, H.; Morikawa, H.; Marumo, F. Phase-transition process of Na2 S O4(III) to Na2 S O4(I) and anharmonic thermal vibration Acta Crystallographica B (39,1983-), 1991, 47, 581-588 |
| 2109088 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.5292; 9.6336; 6.7597 90; 102.209; 90 | 351.92 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2108876 | CIF HKL Paper | C6 H9 N3 O2 | P 1 21 1 | 5.1651; 7.2324; 9.4957 90; 97.065; 90 | 352.03 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108882 | CIF HKL | C6 H9 N3 O2 | P 1 21 1 | 5.1651; 7.2324; 9.4957 90; 97.065; 90 | 352.03 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 1008038 | CIF | As2 H4 O8 Sr | P -1 | 8.707; 7.872; 5.939 86.354; 110.335; 112.241 | 352.2 | Boudjada, A Structure cristalline du monoarseniate diacide de strontium Sr (H~2~ As O~4~)~2~ Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1050-1052 |
| 2103295 | CIF Paper | Bi0.5 Na0.5 O3 Ti | R 3 c :H | 5.4887; 5.4887; 13.5048 90; 90; 120 | 352.34 | Jones, G. O.; Thomas, P. A. Investigation of the structure and phase transitions in the novel A-site substituted distorted perovskite compound Na~0.5~Bi~0.5~TiO~3~ Acta Crystallographica Section B, 2002, 58, 168-178 |
| 2101539 | CIF Paper | H I O Sr | P n m a | 7.7294; 4.24697; 10.7374 90; 90; 90 | 352.472 | Peter, S.; Cockcroft, J. K.; Roisnel, T.; Lutz, H. D. Distance limits of OH···<i>Y</i> hydrogen bonds (<i>Y</i> = Cl, Br, I) in solid hydroxides, structure refinement of laurionite-type Ba(OD)I, Sr(OD)I and Sr(OH)I by neutron and synchrotron X-ray powder diffraction Acta Crystallographica Section B, 1996, 52, 423-427 |
| 2106215 | CIF | H2 O4 U | P b c a | 5.6438; 6.2867; 9.9372 90; 90; 90 | 352.581 | Taylor, J.C.; Hurst, H.J. The hydrogen atom locations in the alpha and beta forms of uranyl hydroxide Acta Crystallographica B (24,1968-38,1982), 1971, 27, 2018-2022 |
| 1001044 | CIF | In0.28 O3 W | P 63/m c m | 7.3673; 7.3673; 7.502 90; 90; 120 | 352.6 | Labbe, P H; Goreaud, M; Raveau, B; Monier, J C Etude comparative des structures M~x~ W O~3~ de type bronze hexagonal. II. Evolution structurale dans la serie des bronzes In~x~ W O~3~ (x equals a number between 0.12 and 0.33) Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1557-1564 |
| 2102121 | CIF Paper | C6 H13 N O2 | P -1 | 5.2493; 5.4006; 13.2778 92.9433; 92.8659; 109.857 | 352.657 | Dalhus, Bjørn; Görbitz, Carl Henrik Structural relationships in crystals accommodating different stereoisomers of 2-amino-3-methylpentanoic acid Acta Crystallographica Section B, 2000, 56, 720-727 |
| 2106166 | CIF | Cr0.964 Fe1.036 | P 42/m n m | 8.7968; 8.7968; 4.5585 90; 90; 90 | 352.754 | Yakel, H.L.jr. Atom distribution in sigma-phases. I. Fe and Cr distribution in a binary phase equilibrated at 1063, 1013 and 923 K Acta Crystallographica B (39,1983-), 1983, 39, 20-28 |
| 1001046 | CIF | In0.31 O3 W | P 63/m c m | 7.3716; 7.3716; 7.5038 90; 90; 120 | 353.1 | Labbe, P H; Goreaud, M; Raveau, B; Monier, J C Etude comparative des structures M~x~ W O~3~ de tyoe bronze hexagonal. II. Evolution structurale dans la serie des bronzes In~x~ W O~3~ (x equals a number between 0.12 and 0.33) Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1557-1564 |
| 1001039 | CIF | In0.17 O3 W | P 63/m c m | 7.3762; 7.3762; 7.4983 90; 90; 120 | 353.3 | Labbe, P H; Goreaud, M; Raveau, B; Monier, J C Etude comparative des structures M~x~ W O~3~ de type bronze hexagonal. II. Evolution structurale dans la serie des bronzes In~x~ W O~3~ (x equals a number between 0.12 and 0.33) Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1557-1564 |
| 1001045 | CIF | In0.3 O3 W | P 63/m c m | 7.375; 7.375; 7.5009 90; 90; 120 | 353.3 | Labbé, P.; Goreaud, M.; Raveau, B.; Monier, J. C. Etude comparative des structures M~x~ W O~3~ de type bronze hexagonal. II. Evolution structurale dans la serie des bronzes In~x~ W O~3~ (x equals a number between 0.12 and 0.33) Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1557-1564 |
| 1001836 | CIF | In0.3 O3 W | P 63/m c m | 7.375; 7.375; 7.5009 90; 90; 120 | 353.3 | Labbe, P H; Goreaud, M; Raveau, B; Monier, J C Etude comparative des structures Mx W O3 de type bronze hexagonal. I. Analyse structurale des bronzes de composition M0.3 W O3 . Stereochimie des elements M=Rb, Tl et In Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1433-1438 |
| 2106326 | CIF | Li O9 P3 Pb | P -1 | 7.245; 7.409; 6.795 100.76; 97.96; 83.74 | 353.578 | Guitel, J.C.; Brunel-Lauegt, M. Structure cristalline du polyphosphate de lithium-plomb. Pb Li (P O3)3 Acta Crystallographica B (24,1968-38,1982), 1977, 33, 2713-2716 |
| 2104422 | CIF HKL Paper | O2 Si | Cc(\a0\g)0 | 5.007; 8.599; 8.2202 90; 91.57; 90 | 353.79 | Graetsch, Heribert A. Modulated crystal structure of incommensurate low tridymite Acta Crystallographica Section B, 2009, 65, 543-550 |
| 2108877 | CIF HKL | C6 H9 N3 O2 | P 1 21 1 | 5.1656; 7.2761; 9.4978 90; 97.316; 90 | 354.07 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108883 | CIF HKL | C6 H9 N3 O2 | P 1 21 1 | 5.1656; 7.2761; 9.4978 90; 97.316; 90 | 354.07 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2105155 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.452; 5.516; 5.606 90; 90; 90 | 354.1 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 1001043 | CIF | In0.24 O3 W | P 63/m c m | 7.3837; 7.3837; 7.5012 90; 90; 120 | 354.2 | Labbe, P H; Goreaud, M; Raveau, B; Monier, J C Etude comparative des structures M~x~ W O~3~ de type bronze hexagonal. II. Evolution structurale dans la serie des bronzes In~x~ W O~3~ (x equals a number between 0.12 and 0.33) Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1557-1564 |
| 1001021 | CIF | O3 Tl0.3 W | P 63/m c m | 7.381; 7.381; 7.5091 90; 90; 120 | 354.3 | Labbe, P H; Goreaud, M; Raveau, B; Monier, J C Etude comparative des structures M~x~ WO~3~ de type bronze hexagonal. I. Analyse structurale des bronzes de composition M~0.30~ W O~3~ . Stereochimie des elements M=Rb, Tl et In Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1433-1438 |
| 1001040 | CIF | In0.15 O3 W | P 63/m c m | 7.3824; 7.3824; 7.5082 90; 90; 120 | 354.4 | Labbe, P H; Goreaud, M; Raveau, B; Monier, J C Etude comparative des structures M~x~ W O~3~ de type bronze hexagonal. II. Evolution structurale dans la serie des bronzes In~x~ W O~3~ (x equals a number between 0.12 and 0.33) Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1557-1564 |
| 2106032 | CIF | H O4 P Sn | P 1 21/c 1 | 4.576; 13.548; 5.785 90; 98.68; 90 | 354.537 | Berndt, A.F.; Lamberg, R. The crystal structure of Sn H P O4 Acta Crystallographica B (24,1968-38,1982), 1971, 27, 1092-1094 |
| 1001041 | CIF | In0.18 O3 W | P 63/m c m | 7.3888; 7.3888; 7.5007 90; 90; 120 | 354.6 | Labbe, P H; Goreaud, M; Raveau, B; Monier, J C Etude comparative des structures M~x~ W O~3~ de type bronze hexagonal. II. Evolution structurale dans la serie des bronzes In~x~ W O~3~ (x equals a number between 0.12 and 0.33) Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1557-1564 |
| 2108648 | CIF Paper | B Fe2.654 Mg0.346 O5 | P b a m | 9.3914; 12.3034; 3.0697 90; 90; 90 | 354.69 | Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Bubnova, Rimma S.; Vagizov, Farit G.; Shablinskii, Andrey P.; Filatov, Stanislav K.; Shilovskikh, Vladimir V.; Pekov, Igor V. Investigation of thermal behavior of mixed-valent iron borates vonsenite and hulsite containing [O<i>M</i>~4~]<i>^n^</i>^+^ and [O<i>M</i>~5~]<i>^n^</i>^+^ oxocentred polyhedra by <i>in situ</i> high-temperature Mössbauer spectroscopy, X-ray diffraction and thermal analysis Acta Crystallographica Section B, 2020, 76, 543-553 |
| 2107014 | CIF | Br6 H12 N4 Pt2 | I m m m | 7.7596; 8.2342; 5.5525 90; 90; 90 | 354.772 | Keller, H.J.; Keppler, B.; Steiger, W.; Ledezma-Sanchez, G. Redetermination of the Structure of trans- diamminedibromoplatinum(II)-trans-diamminetetrabromoplatinu (IV), trans- ((Pt Br2 (N H3)2) (Pt Br4 (N H3)2)) Acta Crystallographica B (24,1968-38,1982), 1981, 37, 674-675 |
| 2102805 | CIF HKL Paper | Ag As3 H2 O9 | P -1 | 7.162; 7.678; 7.88 110.72; 106.47; 105.43 | 354.8 | Schwendtner, Karolina; Kolitsch, Uwe Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members Acta Crystallographica Section B, 2007, 63, 205-215 |
| 1001042 | CIF | In0.21 O3 W | P 63/m c m | 7.3883; 7.3883; 7.5065 90; 90; 120 | 354.9 | Labbe, P H; Goreaud, M; Raveau, B; Monier, J C Etude comparative des structures M~x~ W O~3~ de type bronze hexagonal. II. Evolution structurale dans la serie des bronzes In~x~ W O~3~ (x equals a number between 0.12 and 0.33) Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1557-1564 |
| 2104449 | CIF Paper | Ba F4 Zn | C m c 21 | 4.19057; 14.51281; 5.83568 90; 90; 90 | 354.908 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2104460 | CIF HKL Paper | Ba F4 Zn | C m c 21 | 4.19057; 14.51281; 5.83568 90; 90; 90 | 354.912 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2104459 | CIF HKL Paper | Ba F4 Zn | C m c 21 | 4.19029; 14.51842; 5.83613 90; 90; 90 | 355.049 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2003104 | CIF Paper | C12 H26 N2 O4 | P 1 | 5.1933; 5.4064; 13.6968 91.516; 98.603; 110.376 | 355.16 | Dalhus, Bjørn; Görbitz, Carl Henrik Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series Acta Crystallographica Section B, 1999, 55, 424-431 |
| 1008736 | CIF | Fe2 O5 P | I 1 2/a 1 | 7.2956; 7.5605; 7.2512 90; 117.368; 90 | 355.2 | Elkaïm, E.; Berar, J. F.; Gleitzer, C.; Malaman, B.; Ijjaali, M.; Lecomte, C. Occurrence of a monoclinic distortion in β-Fe~2~PO~5~ Acta Crystallographica, Section B: Structural Science, 1996, 52, 428-431 |
| 2106424 | CIF | Cd Li2 O4 Si | P m n b | 6.479; 10.715; 5.119 90; 90; 90 | 355.374 | Riekel, C. Dilithium cadmium orthosilicate Acta Crystallographica B (24,1968-38,1982), 1977, 33, 2656-2657 |
| 2104458 | CIF HKL Paper | Ba F4 Zn | C m c 21 | 4.1911; 14.52846; 5.83737 90; 90; 90 | 355.439 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2107208 | CIF | Ge0.5 Li3.504 O4 V0.5 | P n m a | 10.9326; 6.3016; 5.1593 90; 90; 90 | 355.439 | Abrahams, I.; Bruce, P.G. Defect clustering in the superionic conductor lithium germanium vanadate Acta Crystallographica B (39,1983-), 1991, 47, 696-701 |
| 2107425 | CIF | H10 O8 S | P -4 21 c | 7.484; 7.484; 6.349 90; 90; 90 | 355.609 | Kjaellman, T.; Olovsson, I. Hydrogen-bond studies. LVIII. The crystal structure of normal and deuterated sulphuric acid tetrahydrate, ((H5 O2)(+))2 (S O4)(2-) and ((D5 O2)(+))2 (S O4)(2-) Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1692-1697 |
| 2107424 | CIF | D10 O8 S | P -4 21 c | 7.482; 7.482; 6.353 90; 90; 90 | 355.643 | Kjaellman, T.; Olovsson, I. Hydrogen-Bond studies. LVIII. The crystal structure of normal and deuterated sulphuric acid tetrahydrate, ((H5 O2)(+))2 (S O4)(2-) and ((D5 O2)(+))2 (S O4)(2-) Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1692-1697 |
| 2105132 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.3887; 11.968; 3.196 90; 97.93; 90 | 355.681 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2102679 | CIF Paper | B Ca H O5 Si | P 1 21/a 1 | 9.646; 7.62; 4.839 90; 90.14; 90 | 355.7 | Ivanov, Yury; Belokoneva, Elena Multipole refinement and electron density analysis in natural borosilicate datolite using X-ray diffraction data Acta Crystallographica Section B, 2007, 63, 49-55 |
| 2108127 | CIF HKL | C10 H16 Co N0 O12 | P -1 | 5.5872; 6.6969; 10.5753 77.217; 74.884; 70.434 | 356.02 | Huang, Xianyu; Chen, Daoliang; He, Mingrui; Li, Jianfeng; Huang, Jiawei; Li, Baolin Crystal structure and luminescent properties of novel coordination polymers constructed with bifurandicarboxylic acid Acta Crystallographica Section B, 2017, 73, 715-721 |
| 2104457 | CIF HKL Paper | Ba F4 Zn | C m c 21 | 4.1935; 14.53894; 5.83952 90; 90; 90 | 356.03 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2107066 | CIF | N4 Th3 | R -3 m :H | 3.875; 3.875; 27.39 90; 90; 120 | 356.177 | Bowman, A.L.; Arnold, G.P. The crystal structure of Th3 N4 Acta Crystallographica B (24,1968-38,1982), 1971, 27, 243-243 |
| 9011088 | CIF | Cl Hg1.5 S | P b m m | 9.328; 8.41; 4.5405 90; 90; 90 | 356.195 | Durovic, S. The crystal structure of gamma-Hg3S2Cl2 Sample: superposition structure Acta Crystallographica, Section B, 1968, 24, 1661-1670 |
| 2100594 | CIF Paper | C3 D7 N O3 | P 21 21 21 | 6.6874; 9.5815; 5.5619 90; 90; 90 | 356.38 | S. A. Moggach; W. G. Marshall; S. Parsons High-pressure neutron diffraction study of L-serine-I and L-serine-II, and the structure of L-serine-III at 8.1 GPa Acta Crystallographica, Section B, 2006, 62, 815-825 |
| 2107077 | CIF | B F3 H4 O2 | P 1 21/c 1 | 5.562; 7.334; 8.746 90; 90.3; 90 | 356.759 | Mootz, D.; Steffen, M. The Structure of Boron Trifluoride Dihydrate, a Redetermination Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1110-1112 |
| 2102006 | CIF Paper | F Nb O2 | R -3 c | 5.52; 5.52; 13.52 90; 90; 120 | 356.768 | Carlson, Stefan; Larsson, Ann-Kristin; Rohrer, Franziska E. High-pressure transformations of NbO~2~F Acta Crystallographica Section B, 2000, 56, 189-196 |
| 2104456 | CIF HKL Paper | Ba F4 Zn | C m c 21 | 4.19684; 14.55067; 5.84241 90; 90; 90 | 356.777 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2106386 | CIF | K4 O4 Sn | P -1 | 6.48; 6.51; 9.7 71.82; 99.89; 113.13 | 356.948 | Marchand, R.; Piffard, Y.; Tournoux, M. Structure cristalline de l'orthostannate de potassium K4 Sn O4 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 511-514 |
| 2100219 | CIF Paper | C2 H3 K N8 O2 | P -1 | 7.031; 11.4089; 4.6788 93.158; 106.749; 83.473 | 356.964 | Leonid A. Solovyov; Alexander M. Astachov; Maxim S. Molokeev; Alexander D. Vasiliev Powder diffraction crystal structure analysis using derivative difference minimization: example of the potassium salt of 1-(tetrazol-5-yl)-2-nitroguanidine Acta Crystallographica Section B, 2005, 61, 435-442 |
| 2106114 | CIF | C1.33 Mn7.53 Si1.8 | P -1 | 6.4492; 6.5187; 9.944 84.709; 99.588; 119.979 | 357.04 | Spinat, P.; Brouty, C.; Whuler, A.; Herpin, P. Etude structurale de la phase Mn8 Si2 C Acta Crystallographica B (24,1968-38,1982), 1975, 31, 541-547 |
| 9016633 | CIF | H1.333 Mg1.333 O5 S | I 41/a m d :2 | 5.242; 5.242; 12.995 90; 90; 90 | 357.084 | Keefer, K. D.; Hochella, Jr, M. F.; de Jong, B. H. W. S. The structure of the magnesium hydroxide sulfate hydrate MgSO4.1/3Mg(OH)2.1/3H2O Acta Crystallographica, Section B, 1981, 37, 1003-1006 |
| 1100075 | CIF | H1.3332 Mg1.3333 O4.9999 S | I 41/a m d :2 | 5.242; 5.242; 12.995 90; 90; 90 | 357.1 | Keefer, K D; Hochella, M F jr.; de Jong, B H W S The Structure of the Magnesium Hydroxide Sulfate Hydrate Mg S O~4~ (Mg (O H)~2~)~.3333~ (H~2~ O)~.3333~ Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1003-1006 |
| 2106656 | CIF | F O3 P Sn | P 1 21/c 1 | 4.621; 12.644; 6.194 90; 99.3; 90 | 357.146 | Berndt, A.F. The crystal structure of Sn P O3 F Acta Crystallographica B (24,1968-38,1982), 1974, 30, 529-530 |
| 2105154 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.4915; 5.5249; 5.6262 90; 90; 90 | 357.2 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 1001020 | CIF | O3 Rb0.28 W | P 63/m c m | 7.3875; 7.3875; 7.5589 90; 90; 120 | 357.3 | Labbe, P H; Goreaud, M; Raveau, B; Monier, J C Etude comparative des structures M~x~ WO~3~ de type bronze hexagonal. I. Analyse structurale des bronzes de composition M~0.30~ W O~3~ . Stereochimie des elements M=Rb, Tl et In Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1433-1438 |
| 9007617 | CIF | O4 Pb W | P 1 21/a 1 | 13.555; 4.976; 5.561 90; 107.63; 90 | 357.471 | Fujita, T.; Kawada, I.; Kato, K. Raspite from Broken Hill Acta Crystallographica, Section B, 1977, 33, 162-164 |
| 2311730 | CIF | Be2 Ca0.55 Ce0.2 Fe0.57 O10 Si2 Y1.25 | P 1 21/c 1 | 4.7514; 7.5719; 9.9414 90; 90.015; 90 | 357.66 | Chukanov, Nikita V.; Aksenov, Sergey M.; Rastsvetaeva, Ramiza K.; Kristiansen, Roy; Pekov, Igor V.; Belakovskiy, Dmitriy I.; Van, Konstantin V.; Bychkova, Yana V.; Britvin, Sergey N. Crystal structure of the OH-dominant gadolinite-(Y) analogue (Y,Ca)<sub>2</sub>(Fe,\σquare )Be<sub>2</sub>Si<sub>2</sub>O<sub>8</sub>(OH,O)<sub>2</sub> from Heftetjern pegmatite, Norway. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 899-906 |
| 2106207 | CIF | Na2 O8 Si3 Zn | P 1 21 1 | 6.66; 8.629; 6.411 90; 103.7; 90 | 357.952 | Hesse, K.F.; Liebau, F.; Boehm, H.; Ribbe, P.H.; Phillips, M.W. Disodium zincosilicate, Na2 Zn Si3 O8 Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1333-1337 |
| 2104455 | CIF HKL Paper | Ba F4 Zn | C m c 21 | 4.20369; 14.57275; 5.84817 90; 90; 90 | 358.255 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2104789 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.5845; 5.4749; 11.721 90; 90; 90 | 358.36 | Tumanov, N. A.; Boldyreva, E. V.; Kolesov, B. A.; Kurnosov, A. V.; Quesada Cabrera, R. Pressure-induced phase transitions in <small>L</small>-alanine, revisited Acta Crystallographica Section B, 2010, 66, 458-471 |
| 2108649 | CIF Paper | B Fe2.654 Mg0.346 O5 | P b a m | 9.425; 12.3528; 3.0799 90; 90; 90 | 358.58 | Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Bubnova, Rimma S.; Vagizov, Farit G.; Shablinskii, Andrey P.; Filatov, Stanislav K.; Shilovskikh, Vladimir V.; Pekov, Igor V. Investigation of thermal behavior of mixed-valent iron borates vonsenite and hulsite containing [O<i>M</i>~4~]<i>^n^</i>^+^ and [O<i>M</i>~5~]<i>^n^</i>^+^ oxocentred polyhedra by <i>in situ</i> high-temperature Mössbauer spectroscopy, X-ray diffraction and thermal analysis Acta Crystallographica Section B, 2020, 76, 543-553 |
| 5000009 | CIF | C6 H9 N3 O2 | P 1 21 1 | 5.172; 7.384; 9.474 90; 97.162; 90 | 358.99 | Madden, J. J.; McGandy, E. L.; Seeman, N. C.; Harding, M. M.; Hoy, A. The crystal structure of the monoclinic form of L-histidine Acta Crystallographica Section B, 1972, 28, 2382-2389 |
| 2106167 | CIF | Cr9.32 Fe15.52 Mn0.37 Mo2.21 Ni2.6 | P 42/m n m | 8.839; 8.839; 4.5973 90; 90; 90 | 359.177 | Yakel, H.L.jr. Atom distributions in sigma-phases. II. Estimations of average site-occupation parameters in a sigme-phase containing Fe, Cr, Ni, Mo and Mn Acta Crystallographica B (39,1983-), 1983, 39, 28-33 |
| 2104770 | CIF HKL Paper | Bi2 Ga4 O9 | P b a m | 7.64; 8.114; 5.794 90; 90; 90 | 359.2 | Friedrich, Alexandra; Juarez-Arellano, Erick A.; Haussühl, Eiken; Boehler, Reinhard; Winkler, Björn; Wiehl, Leonore; Morgenroth, Wolfgang; Burianek, Manfred; Mühlberg, Manfred Persistence of the stereochemical activity of the Bi^3+^ lone electron pair in Bi~2~Ga~4~O~9~ up to 50GPa and crystal structure of the high-pressure phase Acta Crystallographica Section B, 2010, 66, 323-337 |
| 2105851 | CIF HKL | C3 H7 N O2 | P 21 21 21 | 6.0049; 7.5908; 7.888 90; 90; 90 | 359.55 | Kapustin, Eugene A.; Minkov, Vasily S.; Boldyreva, Elena V. Effect of pressure on methylated glycine derivatives: relative roles of hydrogen bonds and steric repulsion of methyl groups Acta Crystallographica Section B, 2014, 70, 517-532 |
| 1000158 | CIF | Cr F5 Mn | C 1 2/c 1 | 8.586; 6.291; 7.381 90; 115.46; 90 | 360 | Ferey, G; de Pape, R; Poulain, M; Grandjean, D; Hardy, A La structure cristalline de Mn Cr F~5~ Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1409-1413 |
| 5000183 | CIF | C H4 N2 S | P b n m | 5.488; 7.663; 8.564 90; 90; 90 | 360.16 | Takahashi, I.; Onodera, A.; Shiozaki, Y. Structural changes of thiourea in connection with its phase transitions: reappraisal of rigidity and libration of the molecule Acta Crystallographica Section B, 1990, 46, 661-664 |
| 2106328 | CIF | Ca2 Sb | I 4 m m | 4.69; 4.69; 16.39 90; 90; 90 | 360.516 | Hamon, C.; Marchand, R.; Laurent, Y.; l'Haridon, P. Etude structurale de Ca2 Sb Acta Crystallographica B (24,1968-38,1982), 1975, 31, 427-430 |
| 2101110 | CIF Paper | C13 H18 N2 O7 | P 1 | 5.9701; 6.7357; 9.577 77.21; 79.95; 75.45 | 360.62 | Wei, Y.; Barton, R.; Robertson, B. Electron-density and electrostatic potential distributions in nucleoside analogs. I. An experimental study of 3'-<i>O</i>-acetyl-2'-deoxy-5-methoxymethyluridine Acta Crystallographica Section B, 1994, 50, 161-174 |
| 2108878 | CIF HKL | C6 H9 N3 O2 | P 1 21 1 | 5.1854; 7.3998; 9.4976 90; 98.182; 90 | 360.72 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108884 | CIF HKL | C6 H9 N3 O2 | P 1 21 1 | 5.1854; 7.3998; 9.4976 90; 98.182; 90 | 360.72 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2107313 | CIF | H O4 P Sn | P 1 21/c 1 | 4.608; 13.603; 5.823 90; 98.76; 90 | 360.743 | Schroeder, L.W.; Prince, E. Hydrogen-bonded dimers in tin(II) hydrogen phosphate Acta Crystallographica B (24,1968-38,1982), 1976, 32, 3309-3311 |
| 2103729 | CIF Paper | In0.54 Nb3 Te4 | P 63/m | 10.6768; 10.6768; 3.6566 90; 90; 120 | 360.986 | Wunschel, Markus; Dinnebier, Robert E.; Carlson, Stefan; van Smaalen, Sander Bulk modulus and non-uniform compression of Nb~3~Te~4~ and In~<i>x~</i>Nb~3~Te~4~ (<i>x</i> < 1) channel compounds Acta Crystallographica Section B, 2001, 57, 665-672 |
| 2103130 | CIF Paper | C16 H16 N2 O5 | P 1 | 4.9325; 8.3343; 9.3502 72.751; 89.414; 80.207 | 361.41 | Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines Acta Crystallographica, Section B, 2002, 58, 530-544 |
| 2105153 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.537; 5.554; 5.6456 90; 90; 90 | 361.8 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 9017337 | CIF | O2 Si | C 2 2 21 | 8.7549; 5.0335; 8.2118 90; 90; 90 | 361.876 | Lee, S.; Xu, H. Using powder XRD and pair distribution function to determine anisotropic atomic displacement parameters of orthorhombic tridymite and tetragonal cristobalite Acta Crystallographica, Section B, 2019, 75 |
| 9007650 | CIF | Fe S | P -6 2 c | 5.963; 5.963; 11.754 90; 90; 120 | 361.948 | King, Jr, H. E.; Prewitt, C. T. High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 0.0001 GPa Acta Crystallographica, Section B, 1982, 38, 1877-1887 |
| 2109087 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.5767; 9.7073; 6.8424 90; 102.262; 90 | 361.96 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2101072 | CIF Paper | C18 H10 Cl2 N2 O2 | P -1 | 3.785; 6.845; 14.485 100.79; 97.6; 80.91 | 361.97 | Mizuguchi, J.; Grubenmann, A.; Rihs, G. Structures of 3,6-bis(3-chlorophenyl)pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione and 3,6-bis(4-chlorophenyl)pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione Acta Crystallographica Section B, 1993, 49, 1056-1060 |
| 9007552 | CIF | H10 Mg O9 S | P -1 | 6.314; 10.505; 6.03 81.12; 109.82; 105.08 | 362.347 | Baur, W. H.; Rolin, J. L. Salt hydrates. IX. The comparison of the crystal structure of magnesium sulfate pentahydrate with copper sulfate pentahydrate and magnesium chromate pentahydrate Locality: synthetic Acta Crystallographica, Section B, 1972, 28, 1448-1455 |
| 1007024 | CIF | Ba H4 O8 P2 | P -1 | 8.032; 7.013; 7.202 109.36; 104.46; 96 | 362.7 | Durif, A; Guitel, J C Structure de la forme triclinique du monophosphate acide de baryum Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1671-1672 |
| 2022050 | CIF | C8 H8 N2 O2 | P -1 | 5.7913; 8.2458; 8.9223 116.823; 104.589; 91.602 | 362.99 | Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76 |
| 2104966 | CIF HKL Paper | C8 H8 N2 O2 | P -1 | 5.7913; 8.2458; 8.9223 116.823; 104.589; 91.602 | 362.99 | Zarychta, Bartosz; Zaleski, Jacek; Kyzioł, Janusz; Daszkiewicz, Zdzisław; Jelsch, Christian Charge-density analysis of 1-nitroindoline: refinement quality using free <i>R</i> factors and restraints Acta Crystallographica Section B, 2011, 67, 250-262 |
| 2105131 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.473; 11.977; 3.2377 90; 98.71; 90 | 363.107 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2103131 | CIF Paper | C16 H16 N2 O5 | P -1 | 4.9566; 8.4178; 9.2538 73.213; 89.915; 79.75 | 363.24 | Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines Acta Crystallographica, Section B, 2002, 58, 530-544 |
| 2102067 | CIF Paper | C8 H4 Li2 O4 | P 1 21/c 1 | 8.35918; 5.13212; 8.48489 90; 93.1555; 90 | 363.45 | Kaduk, James A. Terephthalate salts: salts of monopositive cations Acta Crystallographica Section B, 2000, 56, 474-485 |
| 2108546 | CIF HKL | F7 H8 N2 Ta | P 4/n m m :2 | 5.8613; 5.8613; 10.5817 90; 90; 90 | 363.53 | Udovenko, Anatoly A.; Slobodyuk, Arseny B.; Emelina, Tatiana B.; Laptash, Natalia M. Fluxional seven-coordinated fluorido- and oxofluoridotantalates Acta Crystallographica Section B, 2019, 75 |
| 2104376 | CIF Paper | K0.05 Na0.95 Nb O3 | R 3 c :H | 5.51848; 5.51848; 13.78476 90; 90; 120 | 363.554 | Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A. Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K) Acta Crystallographica Section B, 2009, 65, 291-299 |
| 2104377 | CIF Paper | K0.05 Na0.95 Nb O3 | R 3 c :H | 5.51972; 5.51972; 13.7835 90; 90; 120 | 363.684 | Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A. Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K) Acta Crystallographica Section B, 2009, 65, 291-299 |
| 2105330 | CIF | C2 H3 F2 N O | P 1 21/c 1 | 5.143; 12.809; 7.037 90; 128.3; 90 | 363.8 | D. O. Hughes; R. W. H. Small The Crystal and Molecular Structure of Difluoroacetamide Acta Crystallographica Sect. B, 1972, 28, 2520-2524 |
| 2104378 | CIF Paper | K0.05 Na0.95 Nb O3 | R 3 c :H | 5.52229; 5.52229; 13.78243 90; 90; 120 | 363.995 | Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A. Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K) Acta Crystallographica Section B, 2009, 65, 291-299 |
| 9011262 | CIF | Mg0.999 O5 Ti2.001 | B b m m | 9.7289; 10.0057; 3.7416 90; 90; 90 | 364.224 | Wechsler, B. A.; Von Dreele, R. B. Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 973 K Acta Crystallographica, Section B, 1989, 45, 542-549 |
| 2104379 | CIF Paper | K0.05 Na0.95 Nb O3 | R 3 c :H | 5.52539; 5.52539; 13.78058 90; 90; 120 | 364.354 | Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A. Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K) Acta Crystallographica Section B, 2009, 65, 291-299 |
| 2103101 | CIF Paper | Fe H2 O5 S | C 1 2/c 1 | 7.1157; 7.518; 7.5988 90; 116.307; 90 | 364.4 | Kaduk, James A. Use of the Inorganic Crystal Structure Database as a problem solving tool Acta Crystallographica, Section B: Structural Science, 2002, 58, 370-379 |
| 2104153 | CIF HKL Paper | Ca1.07 Ge Mg0.93 O4 | P n m a | 11.2882; 6.4309; 5.0223 90; 90; 90 | 364.59 | Redhammer, Günther J.; Roth, Georg; Amthauer, Georg; Lottermoser, Werner On the crystal chemistry of olivine-type germanate compounds, Ca~1+<i>x~</i><i>M</i>~1{-~<i>x</i>}GeO~4~ (<i>M</i>^2+^ = Ca, Mg, Co, Mn) Acta Crystallographica Section B, 2008, 64, 261-271 |
| 2104387 | CIF Paper | K0.05 Na0.95 Nb O3 | R 3 c :H | 5.5298; 5.5298; 13.7692 90; 90; 120 | 364.63 | Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A. Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K) Acta Crystallographica Section B, 2009, 65, 291-299 |
| 2105850 | CIF HKL | C3 H7 N O2 | P 21 21 21 | 5.9823; 7.6367; 7.9823 90; 90; 90 | 364.67 | Kapustin, Eugene A.; Minkov, Vasily S.; Boldyreva, Elena V. Effect of pressure on methylated glycine derivatives: relative roles of hydrogen bonds and steric repulsion of methyl groups Acta Crystallographica Section B, 2014, 70, 517-532 |
| 9011263 | CIF | Mg O5 Ti2 | B b m m | 9.7492; 9.9896; 3.746 90; 90; 90 | 364.825 | Wechsler, B. A.; Von Dreele, R. B. Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 1773 Acta Crystallographica, Section B, 1989, 45, 542-549 |
| 2104380 | CIF Paper | K0.05 Na0.95 Nb O3 | R 3 c :H | 5.52922; 5.52922; 13.77931 90; 90; 120 | 364.826 | Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A. Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K) Acta Crystallographica Section B, 2009, 65, 291-299 |
| 9007651 | CIF | Fe S | P -6 2 c | 5.999; 5.999; 11.71 90; 90; 120 | 364.96 | King, Jr, H. E.; Prewitt, C. T. High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 393 K, P = 0.0001 GPa Acta Crystallographica, Section B, 1982, 38, 1877-1887 |
| 9011153 | CIF | C H2 Na2 O4 | P 21 a b | 6.472; 10.724; 5.259 90; 90; 90 | 365.005 | Wu, K. K.; Brown, I. D. A neutron diffraction study of Na2CO3*H2O Acta Crystallographica, Section B, 1975, 31, 890-892 |
| 2104151 | CIF HKL Paper | Ca1.11 Co0.89 Ge O4 | P n m a | 11.2873; 6.4369; 5.0245 90; 90; 90 | 365.06 | Redhammer, Günther J.; Roth, Georg; Amthauer, Georg; Lottermoser, Werner On the crystal chemistry of olivine-type germanate compounds, Ca~1+<i>x~</i><i>M</i>~1{-~<i>x</i>}GeO~4~ (<i>M</i>^2+^ = Ca, Mg, Co, Mn) Acta Crystallographica Section B, 2008, 64, 261-271 |
| 2104150 | CIF HKL Paper | Ca1.11 Co0.89 Ge O4 | P n m a | 11.2923; 6.4369; 5.0246 90; 90; 90 | 365.23 | Redhammer, Günther J.; Roth, Georg; Amthauer, Georg; Lottermoser, Werner On the crystal chemistry of olivine-type germanate compounds, Ca~1+<i>x~</i><i>M</i>~1{-~<i>x</i>}GeO~4~ (<i>M</i>^2+^ = Ca, Mg, Co, Mn) Acta Crystallographica Section B, 2008, 64, 261-271 |
| 2104837 | CIF Paper | C7 H5 N3 O2 | P -1 | 3.7639; 6.5389; 15.141 80.829; 83.77; 86.189 | 365.25 | Takayama, Terufumi; Mitsumori, Takahiro; Kawano, Masaki; Sekine, Akiko; Uekusa, Hidehiro; Ohashi, Yuji; Sugawara, Tadashi Direct observation of arylnitrene formation in the photoreaction of arylazide crystals Acta Crystallographica Section B, 2010, 66, 639-646 |
| 2105152 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.572; 5.567; 5.671 90; 90; 90 | 365.3 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2104788 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.6083; 5.5139; 11.815 90; 90; 90 | 365.36 | Tumanov, N. A.; Boldyreva, E. V.; Kolesov, B. A.; Kurnosov, A. V.; Quesada Cabrera, R. Pressure-induced phase transitions in <small>L</small>-alanine, revisited Acta Crystallographica Section B, 2010, 66, 458-471 |
| 2104149 | CIF HKL Paper | Ca1.16 Ge Mg0.83 O4 | P n m a | 11.2916; 6.4405; 5.0251 90; 90; 90 | 365.44 | Redhammer, Günther J.; Roth, Georg; Amthauer, Georg; Lottermoser, Werner On the crystal chemistry of olivine-type germanate compounds, Ca~1+<i>x~</i><i>M</i>~1{-~<i>x</i>}GeO~4~ (<i>M</i>^2+^ = Ca, Mg, Co, Mn) Acta Crystallographica Section B, 2008, 64, 261-271 |
| 2311753 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0209; 5.0209; 16.7515 90; 90; 120 | 365.719 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2104905 | CIF Paper | Al O4 P | P -1 | 6.1328; 7.5151; 8.5801 98.263; 104.622; 102.14 | 365.895 | Kanzaki, Masami; Xue, Xianyu; Reibstein, Sindy; Berryman, Eleanor; Namgung, Seonyi Structures of two new high-pressure forms of AlPO~4~ by X-ray powder diffraction and NMR spectroscopy Acta Crystallographica Section B, 2011, 67, 30-40 |
| 2106488 | CIF | Cu20 Sn6 | P 63 | 7.33; 7.33; 7.864 90; 90; 120 | 365.917 | Brandon, J.K.; Pearson, W.B.; Tozer, D.J.N. A single-crystal X-ray diffraction of the zeta bronze structure, Cu20 Sn6 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 774-779 |
| 2103593 | CIF Paper | C6 H12 O5 | P 1 21 1 | 6.2238; 8.1389; 7.3637 90; 101.146; 90 | 365.971 | Evdokimov, Artem; Gilboa, A. Joseph; Koetzle, Thomas F.; Klooster, Wim T.; Schultz, Arthur J.; Mason, Sax A.; Albinati, Alberto; Frolow, Felix Structures of furanosides: geometrical analysis of low-temperature X-ray and neutron crystal structures of five crystalline methyl pentofuranosides Acta Crystallographica Section B, 2001, 57, 213-220 |
| 2311755 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0206; 5.0206; 16.7875 90; 90; 120 | 366.46 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2104393 | CIF HKL Paper | B Be2 Cs F2 O3 | R 3 2 :H | 4.4575; 4.4575; 21.31 90; 90; 120 | 366.69 | McMillen, Colin D.; Hu, Jia; VanDerveer, Donald; Kolis, Joseph W. Trigonal structures of <i>A</i>Be~2~BO~3~F~2~ (<i>A</i> = Rb, Cs, Tl) crystals Acta Crystallographica Section B, 2009, 65, 445-449 |
| 2311754 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0214; 5.0214; 16.7931 90; 90; 120 | 366.7 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311756 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0217; 5.0217; 16.8037 90; 90; 120 | 366.98 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311759 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0256; 5.0256; 16.782 90; 90; 120 | 367.07 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311760 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.027; 5.027; 16.778 90; 90; 120 | 367.19 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2100189 | CIF Paper | C Ca O3 | R -3 c :H | 4.987; 4.987; 17.058 90; 90; 120 | 367.4 | Caspi, El'ad N.; Pokroy, Boaz; Lee, Peter L.; Quintana, John P.; Zolotoyabko, Emil On the structure of aragonite Acta Crystallographica Section B, 2005, 61, 129-132 |
| 2107215 | CIF | B6 P0.79 | R -3 m :H | 5.984; 5.984; 11.85 90; 90; 120 | 367.479 | Amberger, E.; Rauh, P.A. Struktur des borreichen Borphosphids Acta Crystallographica B (24,1968-38,1982), 1974, 30, 2549-2553 |
| 2311757 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0224; 5.0224; 16.8222 90; 90; 120 | 367.48 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311761 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0277; 5.0277; 16.7972 90; 90; 120 | 367.71 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 9007689 | CIF | C Ca O3 | R -3 c :H | 4.988; 4.988; 17.068 90; 90; 120 | 367.761 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N. Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3 Acta Crystallographica, Section B, 1995, 51, 929-939 |
| 2100448 | CIF Paper | C6 Cl4 D2 | P -1 | 3.76062; 10.58794; 9.44562 92.4066; 98.6978; 97.5893 | 367.779 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
| 2105398 | CIF | Au7 I P10 | P -3 1 m | 6.18; 6.18; 11.122 90; 90; 120 | 367.867 | Jeitschko, W.; Moeller, M.H. The crystal structures of Au P3 and Au7 P10 I, polyphosphides with weak Au-Au interactions Acta Crystallographica B (24,1968-38,1982), 1979, 35, 573-579 |
| 2107325 | CIF | As Na S2 | P 1 21/c 1 | 7.873; 11.291; 5.569 90; 131.99; 90 | 367.952 | Palazzi, M.; Jaulmes, S. Metadithioarsenite sodique a chaines infinies Acta Crystallographica B (24,1968-38,1982), 1977, 33, 908-910 |
| 2104769 | CIF HKL Paper | Bi2 Ga4 O9 | P b a m | 7.7333; 8.173; 5.8228 90; 90; 90 | 368 | Friedrich, Alexandra; Juarez-Arellano, Erick A.; Haussühl, Eiken; Boehler, Reinhard; Winkler, Björn; Wiehl, Leonore; Morgenroth, Wolfgang; Burianek, Manfred; Mühlberg, Manfred Persistence of the stereochemical activity of the Bi^3+^ lone electron pair in Bi~2~Ga~4~O~9~ up to 50GPa and crystal structure of the high-pressure phase Acta Crystallographica Section B, 2010, 66, 323-337 |
| 2017778 | CIF Paper | C22 H8 Cl2 O2 | P -1 | 3.795; 9.527; 10.662 105.78; 93.27; 95.26 | 368.04 | Schmidt, Martin U.; Paulus, Erich F.; Rademacher, Nadine; Day, Graeme M. Experimental and predicted crystal structures of Pigment Red 168 and other dihalogenated anthanthrones Acta Crystallographica Section B, 2010, 66, 515-526 |
| 2100992 | CIF Paper | C Ca O3 | R -3 c :H | 4.991; 4.991; 17.062 90; 90; 120 | 368.1 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R. X-ray study of the electron density in calcite, CaCo~3~ Acta Crystallographica Section B, 1993, 49, 636-641 |
| 2311758 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0228; 5.0228; 16.862 90; 90; 120 | 368.41 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2104144 | CIF Paper | Ca1.17 Co0.83 Ge O4 | P n m a | 11.3021; 6.4657; 5.0435 90; 90; 90 | 368.56 | Redhammer, Günther J.; Roth, Georg; Amthauer, Georg; Lottermoser, Werner On the crystal chemistry of olivine-type germanate compounds, Ca~1+<i>x~</i><i>M</i>~1{-~<i>x</i>}GeO~4~ (<i>M</i>^2+^ = Ca, Mg, Co, Mn) Acta Crystallographica Section B, 2008, 64, 261-271 |
| 2103099 | CIF Paper | Cl2 H2 Mg O | P n m a | 8.899; 3.634; 11.398 90; 90; 90 | 368.6 | Kaduk, James A. Use of the Inorganic Crystal Structure Database as a problem solving tool Acta Crystallographica, Section B: Structural Science, 2002, 58, 370-379 |
| 9016666 | CIF | H2.3 Mg5 O10 Si2 | P 21/b 1 1 | 4.752; 10.35; 7.914 108.71; 90; 90 | 368.666 | Yamamoto, K. The crystal structure of hydroxyl-chondrodite Acta Crystallographica, Section B, 1977, 33, 1481-1485 |
| 2103872 | CIF HKL Paper | C17 H15 N5 O2 | P 1 | 4.7622; 5.8123; 13.5635 79.851; 87.346; 89.692 | 369.16 | Melguizo, Manuel; Quesada, Antonio; Low, John N.; Glidewell, Christopher Supramolecular structures of <i>N</i>^4^-substituted 2,4-diamino-6-benzyloxy-5-nitrosopyrimidines Acta Crystallographica Section B, 2003, 59, 263-276 |
| 2104787 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.6084; 5.552; 11.857 90; 90; 90 | 369.2 | Tumanov, N. A.; Boldyreva, E. V.; Kolesov, B. A.; Kurnosov, A. V.; Quesada Cabrera, R. Pressure-induced phase transitions in <small>L</small>-alanine, revisited Acta Crystallographica Section B, 2010, 66, 458-471 |
| 2108209 | CIF | C4 H4 O4 | P b c a | 4.7321; 6.9298; 11.2798 90; 90; 90 | 369.89 | Hutchison, Ian B.; Bull, Craig L.; Marshall, William G.; Parsons, Simon; Urquhart, Andrew J.; Oswald, Iain D. H. Compression of glycolide-h~4~ to 6GPa Acta Crystallographica Section B, 2017, 73, 1151-1157 |
| 2106682 | CIF | Ga O3 Y | P 63 c m | 6.065; 6.065; 11.615 90; 90; 120 | 370.008 | Geller, S.; Jeffries, J.B.; Curlander, P.J. The crystal structure of a new high-temperature modification of Y Ga O3 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2770-2774 |
| 2106368 | CIF | Na2 O4 Te | P b c n | 5.798; 12.24; 5.214 90; 90; 90 | 370.025 | Kratochvil, B.; Jensovsky, L. The crystal structure of sodium metatellurate Acta Crystallographica B (24,1968-38,1982), 1977, 33, 2596-2598 |
| 2105151 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.5877; 5.617; 5.6894 90; 90; 90 | 370.3 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2107391 | CIF | Cd1.3332 Na0.3333 O3.9996 V0.9999 | P n 21 a | 9.82; 7.04; 5.36 90; 90; 90 | 370.552 | Ben Amara, M.; Vlasse, M.; Olazcuaga, R.; le Flem, G. The Crystal Structure of Cadmium Sodium Orthovanadate Cd4 Na (V O4)3 Acta Crystallographica B (24,1968-38,1982), 1979, 35, 50-52 |
| 2105849 | CIF HKL | C3 H7 N O2 | P 21 21 21 | 5.9522; 7.6818; 8.1087 90; 90; 90 | 370.76 | Kapustin, Eugene A.; Minkov, Vasily S.; Boldyreva, Elena V. Effect of pressure on methylated glycine derivatives: relative roles of hydrogen bonds and steric repulsion of methyl groups Acta Crystallographica Section B, 2014, 70, 517-532 |
| 2108783 | CIF HKL Paper | C14 H16 N2 O8 Zn | P -1 | 7.2924; 7.445; 8.0936 97.966; 103.385; 115.659 | 370.76 | May, Nóra Veronika; Nys, Kevin; Ching, H. Y. Vincent; Bereczki, Laura; Holczbauer, Tamás; Di Marco, Valerio B.; Bombicz, Petra Crystal structures of zinc(II) complexes with β-hydroxypyridinecarboxylate ligands: examples of structure-directing effects used in inorganic crystal engineering Acta Crystallographica Section B, 2021, 77 |
| 2106809 | CIF | Be Cs F3 | P n m a | 4.828; 6.004; 12.794 90; 90; 90 | 370.864 | Steinfink, H.; Brunton, G.D. The crystal structure of Cs Be F3 Acta Crystallographica B (24,1968-38,1982), 1968, 24, 807-810 |
| 2108548 | CIF HKL | F7 Rb2 Ta | P 4/n m m :2 | 5.9118; 5.9118; 10.6173 90; 90; 90 | 371.07 | Udovenko, Anatoly A.; Slobodyuk, Arseny B.; Emelina, Tatiana B.; Laptash, Natalia M. Fluxional seven-coordinated fluorido- and oxofluoridotantalates Acta Crystallographica Section B, 2019, 75 |
| 2109079 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.5087; 9.8814; 6.9315 90; 100.379; 90 | 371.13 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2100593 | CIF Paper | C3 D7 N O3 | P 21 21 21 | 6.87; 9.6396; 5.6058 90; 90; 90 | 371.24 | S. A. Moggach; W. G. Marshall; S. Parsons High-pressure neutron diffraction study of L-serine-I and L-serine-II, and the structure of L-serine-III at 8.1 GPa Acta Crystallographica, Section B, 2006, 62, 815-825 |
| 1000159 | CIF | Cr F5 Mn | C 1 2/c 1 | 8.856; 6.291; 7.381 90; 115.46; 90 | 371.3 | Ferey, G; de Pape, R; Boucher, B Structure magnetique du fluorure antiferromagnetique Mn Cr F~5~ Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1084-1091 |
| 1000160 | CIF | Cr F5 Mn | C 1 2/c 1 | 8.856; 6.291; 7.381 90; 115.46; 90 | 371.3 | Ferey, G; de Pape, R; Boucher, B Structure cristalline du fluorure antiferromagnetique Mn Cr F~5~ Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1084-1091 |
| 2108598 | CIF HKL | C21 H14 N2 O2 | P -1 | 3.82563; 6.50848; 15.2148 89.522; 91.9447; 101.226 | 371.37 | Schlesinger, Carina; Hammer, Sonja M.; Gorelik, Tatiana E.; Schmidt, Martin U. Orientational disorder of monomethyl-quinacridone investigated by Rietveld refinement, structure refinement to the pair distribution function and lattice-energy minimizations Acta Crystallographica Section B, 2020, 76 |
| 1100050 | CIF | Al16 Cr9.5 | R 3 m :R | 7.811; 7.811; 7.811 109.13; 109.13; 109.13 | 371.42 | Brandon, J. K.; Pearson, W. B.; Riley, P. W.; Chien, C.; Stokhuyzen, R. γ-Brasses with R cells Acta Crystallographica Section B, 1977, 33, 1088-1095 |
| 2106725 | CIF | In2 O5 V | P n m a | 7.232; 3.468; 14.82 90; 90; 90 | 371.694 | Senegas, J.; Manaud, J.P.; Galy, J. Sur un nouveau type d'oxydes doubles M(IV) In2 O5 (M = Ti, V): etude cristallochimique Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1614-1618 |
| 2105586 | CIF Paper | C7 H8 O2 S | P -1 | 7.5941; 7.8219; 7.9811 63.112; 64.66; 89.636 | 371.7 | Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C. Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents Acta Crystallographica Section B, 1999, 55, 963-974 |
| 2106461 | CIF | As2 Eu4 O | I 4/m m m | 4.7924; 4.7924; 16.1933 90; 90; 90 | 371.913 | Wang, Y.; Calvert, L.D.; Taylor, J.B.; Gabe, E.J. Europium arsenic oxide Eu4 As2 O . A filled La2 Sb structure and its relation to the K2 Ni F4 and Ge Te U types Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3122-3125 |
| 2102791 | CIF Paper | Cl2 H2 Mg O | P n m a | 8.9171; 3.63421; 11.4775 90; 90; 90 | 371.95 | Sugimoto, Kunihisa; E. Dinnebier, Robert; Jonathan C. Hanson Crystal structures of dehydration products of Bischofite, MgCl2 nH2O (n = 1, 2, 4) from in situ synchrotron powder diffraction data Acta Crystallographica, Section B, 2007, 63, 235-242 |
| 2105988 | CIF HKL Paper | Fe3.539 H4 O9 Si1.461 | C 1 m 1 | 5.5033; 9.5289; 7.3328 90; 104.493; 90 | 372.3 | Hybler, Jiří Refinement of cronstedtite-1<i>M</i> Acta Crystallographica Section B, 2014, 70, 963-972 |
| 2105150 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.617; 5.611; 5.7156 90; 90; 90 | 372.6 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2106411 | CIF | Ca Cu3 Ge4 O12 | I m -3 | 7.202; 7.202; 7.202 90; 90; 90 | 373.559 | Ozaki, Y.; Ghedira, M.; Joubert, J.C.; Chenavas, J.; Marezio, M. High-pressure sythesis and bond lengths of calcium copper germanium oxide (Ca Cu3)(Ge4) O12 Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3615-3617 |
| 2102909 | CIF Paper | Bi Fe O3 | R 3 c :H | 5.57882; 5.57882; 13.86932 90; 90; 120 | 373.827 | Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study Acta Crystallographica Section B, 2007, 63, 537-544 |
| 2100500 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.5316; 5.553; 9.4148 90; 108.253; 90 | 373.94 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
| 2100501 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.5335; 5.5545; 9.4126 90; 108.256; 90 | 374.04 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
| 2100242 | CIF Paper | C3 H7 N O3 | P 21 21 21 | 6.9083; 9.644; 5.6166 90; 90; 90 | 374.2 | Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa Acta Crystallographica Section B, 2005, 61, 58-68 |
| 2108792 | CIF HKL | C3 H17 Al N2 O14 S2 | P -3 m 1 | 6.868; 6.868; 9.1617 90; 90; 120 | 374.25 | Zarychta, Bartosz; Czapla, Zbigniew; Przesławski, Janusz; Szklarz, Przemysław Structure, ferroelasticity and Goldilocks zone phase transitions in C~3~H~5~N~2~Al(SO~4~)~2~·6H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2109078 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.5204; 9.8941; 6.9655 90; 100.34; 90 | 374.27 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2104786 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.6254; 5.573; 11.942 90; 90; 90 | 374.4 | Tumanov, N. A.; Boldyreva, E. V.; Kolesov, B. A.; Kurnosov, A. V.; Quesada Cabrera, R. Pressure-induced phase transitions in <small>L</small>-alanine, revisited Acta Crystallographica Section B, 2010, 66, 458-471 |
| 9007554 | CIF | N Na O3 | R -3 c :H | 5.07; 5.07; 16.82 90; 90; 120 | 374.432 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 20 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007561 | CIF | N Na O3 | R -3 c :H | 5.07; 5.07; 16.82 90; 90; 120 | 374.432 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 20 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 2312706 | CIF HKL | C10 H9 Cu2 Mo2 N2 O8.5 | P -1 | 5.612; 5.7724; 12.4665 95.99; 93.999; 110.227 | 374.444 | Moya, Marielsys; Liendo-Polanco, Gustavo R; Atencio, Reinaldo; Silva, Pedro; Henao, Jose A.; Bruno-Colmenares, Julia Coordination geometry flexibility driving supramolecular isomerism of Cu/Mo pillared-layer hybrid networks. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 782-792 |
| 2108791 | CIF HKL | C3 H17 Al N2 O14 S2 | P -3 m 1 | 6.8748; 6.8748; 9.155 90; 90; 120 | 374.72 | Zarychta, Bartosz; Czapla, Zbigniew; Przesławski, Janusz; Szklarz, Przemysław Structure, ferroelasticity and Goldilocks zone phase transitions in C~3~H~5~N~2~Al(SO~4~)~2~·6H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2104363 | CIF Paper | Ba O11 V6 | P 63 m c | 5.739; 5.739; 13.144 90; 90; 120 | 374.9 | Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~ Acta Crystallographica Section B, 2009, 65, 326-333 |
| 2105112 | CIF Paper | C3 H7 N O3 | P 21 21 21 | 5.631; 6.921; 9.619 90; 90; 90 | 374.9 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2104381 | CIF Paper | K0.3 Na0.7 Nb O3 | R 3 c :H | 5.59214; 5.59214; 13.843 90; 90; 120 | 374.901 | Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A. Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K) Acta Crystallographica Section B, 2009, 65, 291-299 |
| 2104382 | CIF Paper | K0.3 Na0.7 Nb O3 | R 3 c :H | 5.59326; 5.59326; 13.8432 90; 90; 120 | 375.057 | Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A. Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K) Acta Crystallographica Section B, 2009, 65, 291-299 |
| 2100449 | CIF Paper | C6 Cl4 D2 | P -1 | 3.799; 10.6258; 9.47938 91.978; 99.058; 96.234 | 375.132 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
| 2100450 | CIF Paper | C6 Cl4 D2 | P 1 21/n 1 | 3.78988; 10.50328; 9.56244 90; 99.7184; 90 | 375.182 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
| 2104383 | CIF Paper | K0.3 Na0.7 Nb O3 | R 3 c :H | 5.59447; 5.59447; 13.8429 90; 90; 120 | 375.211 | Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A. Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K) Acta Crystallographica Section B, 2009, 65, 291-299 |
| 9015028 | CIF | B F4 H4 N | P n m a | 9.077; 5.679; 7.279 90; 90; 90 | 375.22 | Caron, A. P.; Ragle, J. L. Refinement of the structure of orthorhombic ammonium tetrafluoroborate, NH4BF4 Acta Crystallographica, Section B, 1971, 27, 1102-1107 |
| 2104384 | CIF Paper | K0.3 Na0.7 Nb O3 | R 3 c :H | 5.59575; 5.59575; 13.8429 90; 90; 120 | 375.383 | Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A. Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K) Acta Crystallographica Section B, 2009, 65, 291-299 |
| 2105391 | CIF | Au2 P3 | C 1 2/m 1 | 5.863; 14.439; 4.674 90; 108.39; 90 | 375.474 | Moeller, M.H.; Jeitschko, W. The crystal structures of Au P3 and Au7 P10 I, polyphosphides with weak Au-Au interactions Acta Crystallographica B (24,1968-38,1982), 1979, 35, 573-579 |
| 2104385 | CIF Paper | K0.3 Na0.7 Nb O3 | R 3 c :H | 5.59717; 5.59717; 13.8423 90; 90; 120 | 375.557 | Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A. Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K) Acta Crystallographica Section B, 2009, 65, 291-299 |
| 2103460 | CIF HKL Paper | H8 N2 O8 S2 | P 1 21/n 1 | 6.134; 7.9324; 7.7541 90; 94.966; 90 | 375.88 | Schmidt, Thorsten; Schmitt, Heike; Zimmermann, Herbert; Haeberlen, Ulrich; Lalowicz, Zdzisław T.; Olejniczak, Zbigniew; Oeser, Thomas Location of the H atoms in ammonium persulphate by deuteron NMR. Verification by X-ray diffraction Acta Crystallographica Section B, 2002, 58, 760-769 |
| 2100447 | CIF Paper | C6 H2 Cl4 | P -1 | 3.8016; 10.6369; 9.4866 92.072; 98.966; 96.52 | 375.91 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
| 2102910 | CIF Paper | Bi Fe O3 | R 3 c :H | 5.58829; 5.58829; 13.904 90; 90; 120 | 376.035 | Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study Acta Crystallographica Section B, 2007, 63, 537-544 |
| 2100499 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.5511; 5.5626; 9.4311 90; 108.221; 90 | 376.28 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
| 2104362 | CIF Paper | Ba O11 V6 | P 63 m c | 5.746; 5.746; 13.16 90; 90; 120 | 376.3 | Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~ Acta Crystallographica Section B, 2009, 65, 326-333 |
| 2102911 | CIF Paper | Bi Fe O3 | R 3 c :H | 5.58986; 5.58986; 13.90943 90; 90; 120 | 376.393 | Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study Acta Crystallographica Section B, 2007, 63, 537-544 |
| 2109101 | CIF HKL Paper | Ba2 O8 Si2 Ti | P 4 b m | 8.5104; 8.5104; 5.1975 90; 90; 90 | 376.44 | Chukanov, Nikita V.; Kazheva, Olga N.; Fischer, Reinhard X.; Aksenov, Sergey M. Refinement of the crystal structure of fresnoite, Ba<sub>2</sub>TiSi<sub>2</sub>O<sub>8</sub>, from Löhley (Eifel district, Germany); Gladstone-Dale compatibility, electronic polarizability and vibrational spectroscopy of minerals and inorganic compounds with pentacoordinated Ti<sup>IV</sup> and a titanyl bond. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 184-194 |
| 1001109 | CIF | Cl Cu Hg Se | P b a m | 6.9444; 12.7561; 4.2526 90; 90; 90 | 376.7 | Guillo, M; Mercey, B; Labbe, P H; Deschanvres, A The Structure of Copper(I) Mercury(II) Chloride Selenide Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2520-2523 |
| 2106434 | CIF | Ca H6 O9 P2 | P -1 | 5.6261; 11.889; 6.473 98.633; 118.2; 83.344 | 376.752 | Schroeder, L.W.; Prince, E.; Dickens, B. Hydrogen bonding in Ca (H2 P O4)2 (H2 O) as determined by neutron diffraction Acta Crystallographica B (24,1968-38,1982), 1975, 31, 9-12 |
| 2102912 | CIF Paper | Bi Fe O3 | R 3 c :H | 5.59227; 5.59227; 13.91782 90; 90; 120 | 376.945 | Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study Acta Crystallographica Section B, 2007, 63, 537-544 |
| 2103326 | CIF Paper | C6 H5 I N2 O2 | P -1 | 6.4236; 7.4979; 8.293 71.422; 85.285; 86.125 | 376.96 | Garden, Simon J.; Fontes, Silvia P.; Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher Interplay of hydrogen bonds, iodo···nitro interactions and aromatic π···π stacking interactions in iodo-nitroanilines Acta Crystallographica Section B, 2002, 58, 701-709 |
| 2108945 | CIF HKL Paper | C20 H10 Cl2 N2 O2 | P -1 | 3.7718; 6.4792; 15.774 93.744; 92.189; 100.918 | 377.2 | Habermehl, Stefan; Schlesinger, Carina; Schmidt, Martin U. Structure determination from unindexed powder data from scratch by a global optimization approach using pattern comparison based on cross-correlation functions Acta Crystallographica Section B, 2022, 78 |
| 2106752 | CIF | F4 O2 Sn4 | C 1 2/m 1 | 9.296; 8.076; 5.074 90; 97.9; 90 | 377.313 | Darriet, B.; Galy, J. Synthese et structure cristalline du bis(difluorooxostannate(II)) d'etain(II), (Sn2 O2 F4) Sn2 Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1489-1492 |
| 2104873 | CIF HKL Paper | As2 Ni2 O7 | P 1 | 19.497; 5.297; 8.868 58.32; 148.78; 127.3 | 377.6 | Weil, Matthias; Stöger, Berthold Crystal chemistry of transition metal diarsenates <i>M</i>~2~As~2~O~7~ (<i>M</i> = Mn, Co, Ni, Zn): variants of the thortveitite structure Acta Crystallographica Section B, 2010, 66, 603-614 |
| 2104361 | CIF Paper | Ba O11 V6 | P 63 m c | 5.754; 5.754; 13.182 90; 90; 120 | 378 | Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~ Acta Crystallographica Section B, 2009, 65, 326-333 |
| 2102662 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0848; 3.0101; 10.4014 90; 92.187; 90 | 378.09 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102666 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0848; 3.0101; 10.4014 90; 92.187; 90 | 378.09 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102667 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0848; 3.0101; 10.4014 90; 92.187; 90 | 378.09 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2109077 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.5329; 9.9018; 7.0147 90; 100.309; 90 | 378.1 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2102663 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0828; 3.0099; 10.4045 90; 92.192; 90 | 378.11 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102668 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0828; 3.0099; 10.4045 90; 92.192; 90 | 378.11 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102669 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0828; 3.0099; 10.4045 90; 92.192; 90 | 378.11 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102913 | CIF Paper | Bi Fe O3 | R 3 c :H | 5.59771; 5.59771; 13.93538 90; 90; 120 | 378.155 | Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study Acta Crystallographica Section B, 2007, 63, 537-544 |
| 9007555 | CIF | N Na O3 | R -3 c :H | 5.074; 5.074; 16.97 90; 90; 120 | 378.367 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 100 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007562 | CIF | N Na O3 | R -3 c :H | 5.074; 5.074; 16.97 90; 90; 120 | 378.367 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 100 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 2102914 | CIF Paper | Bi Fe O3 | R 3 c :H | 5.59922; 5.59922; 13.94046 90; 90; 120 | 378.497 | Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study Acta Crystallographica Section B, 2007, 63, 537-544 |
| 2104592 | CIF Paper | C18 H20 O4 | P -1 | 10.376; 8.884; 4.378 83.046; 84.413; 71.181 | 378.5 | Marsh, Richard E. Space groups <i>P</i>1 and <i>Cc</i>: how are they doing? Acta Crystallographica Section B, 2009, 65, 782-783 |
| 2108208 | CIF | C4 H4 O4 | P b c a | 4.7757; 6.993; 11.3384 90; 90; 90 | 378.66 | Hutchison, Ian B.; Bull, Craig L.; Marshall, William G.; Parsons, Simon; Urquhart, Andrew J.; Oswald, Iain D. H. Compression of glycolide-h~4~ to 6GPa Acta Crystallographica Section B, 2017, 73, 1151-1157 |
| 2106305 | CIF | H6 N4 O9 | P 2 21 21 | 6.57; 12.64; 4.56 90; 90; 90 | 378.684 | Einstein, F.W.B.; Tuck, D.G. A refinement of the crystal structure of N H4 N O3 (H N O3)2 Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1117-1120 |
| 2105149 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.6535; 5.681; 5.7217 90; 90; 90 | 378.8 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2102915 | CIF Paper | Bi Fe O3 | R 3 c :H | 5.60065; 5.60065; 13.94476 90; 90; 120 | 378.807 | Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study Acta Crystallographica Section B, 2007, 63, 537-544 |
| 2101577 | CIF Paper | Ba2 O8 Si2 Ti | P 4 b m | 8.527; 8.527; 5.2104 90; 90; 90 | 378.85 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2100451 | CIF Paper | C6 Cl4 D2 | P 1 21/n 1 | 3.81117; 10.53867; 9.57198 90; 99.7088; 90 | 378.949 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
| 2104366 | CIF HKL Paper | Cl Cu2 H3 O3 | P 1 21/n 1 | 6.1226; 6.8346; 9.1841 90; 99.577; 90 | 378.96 | Malcherek, Thomas; Schlüter, Jochen Structures of the pseudo-trigonal polymorphs of Cu~2~(OH)~3~Cl Acta Crystallographica Section B, 2009, 65, 334-341 |
| 2102661 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.1008; 3.0113; 10.41 90; 92.258; 90 | 379.04 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102664 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.1008; 3.0113; 10.41 90; 92.258; 90 | 379.04 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102665 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.1008; 3.0113; 10.41 90; 92.258; 90 | 379.04 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2104466 | CIF Paper | Ba F4 Mn | X21(1/21/2\g)0 | 4.198368; 15.0556; 6.00025 90; 90; 90.0853 | 379.269 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2104450 | CIF Paper | Ba F4 Mn | X21(000)0 | 4.198431; 15.0557; 6.0003 90; 90; 90.0849 | 379.28 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2104465 | CIF Paper | Ba F4 Mn | X21(1/21/2\g)0 | 4.198482; 15.0572; 6.00025 90; 90; 90.0843 | 379.32 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 9011148 | CIF | Cl H4 Na O2 | P 1 21/c 1 | 6.3313; 10.1178; 6.5029 90; 114.407; 90 | 379.341 | Klewe, B.; Pedersen, B. The crystal structure of sodium chloride dihydrate Acta Crystallographica, Section B, 1974, 30, 2363-2371 |
| 2104147 | CIF HKL Paper | Ca1.14 Ge Mn0.86 O4 | P n m a | 11.326; 6.5604; 5.1069 90; 90; 90 | 379.46 | Redhammer, Günther J.; Roth, Georg; Amthauer, Georg; Lottermoser, Werner On the crystal chemistry of olivine-type germanate compounds, Ca~1+<i>x~</i><i>M</i>~1{-~<i>x</i>}GeO~4~ (<i>M</i>^2+^ = Ca, Mg, Co, Mn) Acta Crystallographica Section B, 2008, 64, 261-271 |
| 2105336 | CIF | Ag0.37 Cr1.21 S2 | R -3 m :H | 3.4325; 3.4325; 37.19 90; 90; 120 | 379.47 | Bronsema, K.D.; Wiegers, G.A. Structure of a non-stoichiometric chromium silver sulphide Acta Crystallographica B (24,1968-38,1982), 1982, 38, 2229-2232 |
| 2104768 | CIF HKL Paper | Bi2 Ga4 O9 | P b a m | 7.848; 8.23; 5.875 90; 90; 90 | 379.5 | Friedrich, Alexandra; Juarez-Arellano, Erick A.; Haussühl, Eiken; Boehler, Reinhard; Winkler, Björn; Wiehl, Leonore; Morgenroth, Wolfgang; Burianek, Manfred; Mühlberg, Manfred Persistence of the stereochemical activity of the Bi^3+^ lone electron pair in Bi~2~Ga~4~O~9~ up to 50GPa and crystal structure of the high-pressure phase Acta Crystallographica Section B, 2010, 66, 323-337 |
| 2105848 | CIF HKL | C3 H7 N O2 | P 21 21 21 | 5.918; 7.7502; 8.2755 90; 90; 90 | 379.56 | Kapustin, Eugene A.; Minkov, Vasily S.; Boldyreva, Elena V. Effect of pressure on methylated glycine derivatives: relative roles of hydrogen bonds and steric repulsion of methyl groups Acta Crystallographica Section B, 2014, 70, 517-532 |
| 2102916 | CIF Paper | Bi Fe O3 | R 3 c :H | 5.60456; 5.60456; 13.9557 90; 90; 120 | 379.634 | Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study Acta Crystallographica Section B, 2007, 63, 537-544 |
| 2106668 | CIF | Pt3 Pu5 | P 63/m c m | 8.49; 8.49; 6.084 90; 90; 120 | 379.783 | Cromer, D.T.; Larson, A.C. The structure of Pu5 Pt3 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1758-1759 |
| 2104360 | CIF Paper | Ba O11 V6 | P 63 m c | 5.763; 5.763; 13.206 90; 90; 120 | 379.8 | Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~ Acta Crystallographica Section B, 2009, 65, 326-333 |
| 2104148 | CIF HKL Paper | Ca1.17 Ge Mn0.83 O4 | P n m a | 11.3256; 6.5643; 5.1098 90; 90; 90 | 379.89 | Redhammer, Günther J.; Roth, Georg; Amthauer, Georg; Lottermoser, Werner On the crystal chemistry of olivine-type germanate compounds, Ca~1+<i>x~</i><i>M</i>~1{-~<i>x</i>}GeO~4~ (<i>M</i>^2+^ = Ca, Mg, Co, Mn) Acta Crystallographica Section B, 2008, 64, 261-271 |
| 2104464 | CIF Paper | Ba F4 Mn | X21(1/21/2\g)0 | 4.201896; 15.06749; 6.00091 90; 90; 90.0724 | 379.929 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2106709 | CIF | Ca2 H4 O9 P2 | P -1 | 7.365; 8.287; 6.691 102.96; 72.73; 95.01 | 379.938 | Mandel, N.S. The crystal structure of calcium pyrophosphate dihydrate Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1730-1734 |
| 2106750 | CIF | C H4 N2 S | P 1 21/c 1 | 4.138; 7.074; 13.09 90; 97.19; 90 | 380.16 | Bats, J.W.; Coppens, P. The experimental charge distribution in sulfur-containing molecules. A study of the deformation density in (N H4) S C N at 81 K by combined X-ray and neutron diffraction Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1542-1548 |
| 9014704 | CIF | Cl Cu2 H3 O3 | P 1 21/n 1 | 6.1675; 6.8327; 9.1517 90; 99.492; 90 | 380.379 | Malcherek, T.; Schluter, J. Structures of the pseudo-trigonal polymorphs of Cu2(OH)3Cl Note: Sample #1 Acta Crystallographica, Section B, 2009, 65, 334-341 |
| 2106378 | CIF | Br2 Cd H8 O4 | P n n m | 12.594; 7.551; 4.002 90; 90; 90 | 380.579 | Leligny, H.; Monier, J.C. Structure cristalline de Cd Br2 (H2 O)4 Acta Crystallographica B (24,1968-38,1982), 1978, 34, 5-8 |
| 2108740 | CIF HKL | C18 H10 Cl2 O2 S2 | P -1 | 3.8612; 8.8249; 11.2319 94.972; 92.244; 90.968 | 380.91 | Sakthidharan, C. P.; Niewa, R.; Zherebtsov, D. A.; Podgornov, F. V.; Matveychuk, Y. V.; Bartashevich, E. V.; Nayfert, S. A.; Adonin, S. A.; Gavrilyak, M. V.; Boronin, V. A.; Polozov, M. A.; Karthikeyan, S.; Sarojadevi, M.; Rajakumar, K.; Prabunathan, P. Crystal structures and dielectric properties of 4,4'-dimethyl-6,6'-dichlorothioindigo (Pigment Red 181) Acta Crystallographica Section B, 2021, 77, 23-30 |
| 2102917 | CIF Paper | Bi Fe O3 | R 3 c :H | 5.61135; 5.61135; 13.9708 90; 90; 120 | 380.966 | Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study Acta Crystallographica Section B, 2007, 63, 537-544 |
| 2104463 | CIF Paper | Ba F4 Mn | X21(1/21/2\g)0 | 4.20914; 15.0845; 6.00165 90; 90; 90.051 | 381.061 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2101281 | CIF Paper | C7 H10 N2 O2 | P -1 | 7.242; 7.991; 8.38 61.98; 63.4; 82.09 | 381.2 | Suwinska, K. Structure and thermochemical properties of some alkyluracils Acta Crystallographica Section B, 1995, 51, 248-254 |
| 9011090 | CIF | Fe7 O10 Si | P 1 21/m 1 | 21.4; 3.06; 5.88 90; 98; 90 | 381.299 | Smuts, J.; Steyn, J. G. D.; Boeyens, J. C. A. The crystal structure of an iron silicate, iscorite Acta Crystallographica, Section B, 1969, 25, 1251-1255 |
| 2107081 | CIF | H8 N2 Ni O10 | P -1 | 7.484; 10.277; 5.476 101.06; 101.53; 68.77 | 381.366 | Morosin, B.; Haseda, T. Crystal structure of the beta-form of Ni (N O3)2 (H2 O)4 Acta Crystallographica B (24,1968-38,1982), 1979, 35, 2856-2858 |
| 2107117 | CIF | C H6 N4 O | P 1 21/c 1 | 3.625; 8.794; 12.456 90; 106.17; 90 | 381.367 | Ottersen, T.; Hope, H. The Structure and Electron Deformation Density Distribution of Carbonohydrazide (Carbohydrazide) at 85 K Acta Crystallographica B (24,1968-38,1982), 1979, 35, 373-378 |
| 2104593 | CIF Paper | C18 H20 O4 | P -1 | 8.32; 8.445; 7.603 118.167; 66.439; 124.566 | 381.4 | Marsh, Richard E. Space groups <i>P</i>1 and <i>Cc</i>: how are they doing? Acta Crystallographica Section B, 2009, 65, 782-783 |
| 2105148 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.677; 5.705; 5.7311 90; 90; 90 | 381.79 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 1007226 | CIF | Cd Cr4 H4 K2 O16 | P -1 | 7.999; 7.956; 6.733 115.18; 80.55; 96.11 | 382.2 | Durif, A; Averbuch-Pouchot, M T Structure du dichromate de cadmium-potassium dihydrate. Cd K2 (Cr2 O7)2 (H2 O) Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1456-1457 |
| 2104462 | CIF HKL Paper | Ba F4 Mn | C m c 21 | 4.218739; 15.0985; 6.0007 90; 90; 90 | 382.224 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 2102918 | CIF Paper | Bi Fe O3 | R 3 c :H | 5.61853; 5.61853; 13.9824 90; 90; 120 | 382.259 | Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study Acta Crystallographica Section B, 2007, 63, 537-544 |
| 2104359 | CIF Paper | Ba O11 V6 | P 63 m c | 5.775; 5.775; 13.238 90; 90; 120 | 382.3 | Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~ Acta Crystallographica Section B, 2009, 65, 326-333 |
| 2105349 | CIF | Ag N O3 | R 3 c :H | 5.16; 5.16; 16.58 90; 90; 120 | 382.309 | Chevalier, R.; Meyer, P.; Rimsky, A. Structure d une phase du nitrate d argent instable a temperature et pression ordinaires Acta Crystallographica B (24,1968-38,1982), 1976, 32, 1143-1146 |
| 2104461 | CIF HKL Paper | Ba F4 Mn | C m c 21 | 4.220243; 15.1002; 6.00012 90; 90; 90 | 382.367 | Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures Acta Crystallographica Section B, 2009, 65, 576-586 |
| 9007556 | CIF | N Na O3 | R -3 c :H | 5.077; 5.077; 17.13 90; 90; 120 | 382.386 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 180 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007563 | CIF | N Na O3 | R -3 c :H | 5.077; 5.077; 17.13 90; 90; 120 | 382.386 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 180 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 2106672 | CIF | B Fe3 O6 | P n m a | 10.048; 8.531; 4.466 90; 90; 90 | 382.823 | Diehl, R.; Brandt, G. Refinement of the crystal structure of Fe3 B O6 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1662-1665 |
| 2105256 | CIF Paper | C8 H8 N2 O2 | P -1 | 3.9506; 8.264; 12.045 78.842; 83.18; 86.99 | 382.9 | Britton, Doyle; Young, Jr, Victor G.; Noland, Wayland E.; Pinnow, Matthew J.; Clark, Christopher M. Four polymorphs (polytypes) of 5,6-dimethylbenzofurazan 1-oxide Acta Crystallographica Section B, 2012, 68, 536-542 |
| 2106115 | CIF | H2 Hg O5 S | P n m a | 7.8796; 5.4209; 8.9704 90; 90; 90 | 383.166 | Stalhandske, C. An X-ray and neutron diffraction study of mercury(II) sulphate monohydrate Acta Crystallographica B (24,1968-38,1982), 1980, 36, 23-26 |
| 2100498 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.5999; 5.5911; 9.4814 90; 107.995; 90 | 383.17 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
| 1100023 | CIF | Ca1.5 O4 Si Sr0.5 | P m n b | 5.647; 7.037; 9.644 90; 90; 90 | 383.2 | Catti, M.; Gazzoni, G.; Ivaldi, G. Order-disorder in the α'-(Ca,Sr)~2~SiO~4~ solid solution: a structural and statistical-thermodynamic analysis Acta Crystallographica, Section B: Structural Science, 1984, 40, 537-544 |
| 1100024 | CIF | Ca1.8 O4 Si Sr0.2 | P m n b | 5.647; 7.037; 9.644 90; 90; 90 | 383.2 | Catti, M.; Gazzoni, G.; Ivaldi, G. Order-disorder in the α'-(Ca,Sr)~2~SiO~4~ solid solution: a structural and statistical-thermodynamic analysis Acta Crystallographica, Section B: Structural Science, 1984, 40, 537-544 |
| 2101651 | CIF Paper | D12 N6 Ni O4 | C 1 2/m 1 | 10.609; 6.773; 5.879 90; 114.86; 90 | 383.3 | Iversen, B. B.; Larsen, F. K.; Figgis, B. N.; Reynolds, P. A.; Schultz, A. J. Atomic displacement parameters for Ni(ND~3~)~4~(NO~2~)~2~ from 9 K X-ray and 13 K time-of-flight neutron diffraction data Acta Crystallographica Section B, 1996, 52, 923-931 |
| 2101652 | CIF Paper | D12 N6 Ni O4 | C 1 2/m 1 | 10.609; 6.773; 5.879 90; 114.86; 90 | 383.3 | Iversen, B. B.; Larsen, F. K.; Figgis, B. N.; Reynolds, P. A.; Schultz, A. J. Atomic displacement parameters for Ni(ND~3~)~4~(NO~2~)~2~ from 9 K X-ray and 13 K time-of-flight neutron diffraction data Acta Crystallographica Section B, 1996, 52, 923-931 |
| 9007582 | CIF | H2 K O4 P | P 21 21 21 | 7.434; 7.434; 6.945 90; 90; 90 | 383.811 | Baur, W. H. Reconstruction of local atomic environments in the disordered hydrogen-bonded crystal structures of paraelectric ammonium dihydrogen phosphate and potassium dihydrogen phosphate Note: known as KDP Note: polymorph of archerite Acta Crystallographica, Section B, 1973, 29, 2726-2731 |
| 2106142 | CIF | Cr2 Os | P 42/m n m | 9.05; 9.05; 4.69 90; 90; 90 | 384.123 | D'Alte da Veiga, L.M.; Costa, M.M.R.; de Almeida, M.J.M.; Andrade, L.R.; Matos Beja, A. The ordering of the sigma-phases Cr2 Ru and Cr2 Os Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1750-1757 |
| 2104152 | CIF HKL Paper | Ca1.31 Ge Mn0.69 O4 | P n m a | 11.3391; 6.6035; 5.1326 90; 90; 90 | 384.32 | Redhammer, Günther J.; Roth, Georg; Amthauer, Georg; Lottermoser, Werner On the crystal chemistry of olivine-type germanate compounds, Ca~1+<i>x~</i><i>M</i>~1{-~<i>x</i>}GeO~4~ (<i>M</i>^2+^ = Ca, Mg, Co, Mn) Acta Crystallographica Section B, 2008, 64, 261-271 |
| 2106384 | CIF | Mn O3 S | R -3 :R | 7.912; 7.912; 7.912 109.241; 109.241; 109.241 | 384.489 | Magnusson, A.; Johansson, L.G. Rhombohedral manganese(II) sulfite Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1400-1401 |
| 2104358 | CIF Paper | Ba O11 V6 | P 63/m m c | 5.785; 5.785; 13.266 90; 90; 120 | 384.5 | Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~ Acta Crystallographica Section B, 2009, 65, 326-333 |
| 9007608 | CIF | Cu H4 Na2 O10 S2 | P 1 21/c 1 | 5.807; 12.656; 5.517 90; 108.32; 90 | 384.912 | Hawthorne, F. C.; Ferguson, R. B. Refinement of the crystal structure of krohnkite Acta Crystallographica, Section B, 1975, 31, 1753-1755 |
| 9007557 | CIF | N Na O3 | R -3 c :H | 5.079; 5.079; 17.23 90; 90; 120 | 384.922 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 230 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007564 | CIF | N Na O3 | R -3 c :H | 5.079; 5.079; 17.23 90; 90; 120 | 384.922 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 230 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 2105483 | CIF HKL Paper | C5 H12 N2 O S | P -1 | 6.847; 7.0982; 8.6412 106.676; 105.448; 90.679 | 386 | Jones, Peter G.; Taouss, Christina; Teschmit, Nicole; Thomas, Lena Methylthioureas and their morpholine and dioxane adducts; hydrogen-bonding patterns Acta Crystallographica Section B, 2013, 69, 405-413 |
| 9007558 | CIF | N Na O3 | R -3 c :H | 5.081; 5.081; 17.27 90; 90; 120 | 386.119 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 250 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007565 | CIF | N Na O3 | R -3 c :H | 5.081; 5.081; 17.27 90; 90; 120 | 386.119 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 250 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 2105847 | CIF HKL | C3 H7 N O2 | P 21 21 21 | 5.923; 7.786; 8.3734 90; 90; 90 | 386.2 | Kapustin, Eugene A.; Minkov, Vasily S.; Boldyreva, Elena V. Effect of pressure on methylated glycine derivatives: relative roles of hydrogen bonds and steric repulsion of methyl groups Acta Crystallographica Section B, 2014, 70, 517-532 |
| 2101621 | CIF Paper | Mo O5 U | P b a a | 12.746; 7.3494; 4.1252 90; 90; 90 | 386.43 | D'yachenko, O. G.; Tabachenko, V. V.; Tali, R.; Kovba, L. M.; Marinder, B.-O.; Sundberg, M. Structure of UMoO~5~ studied by single-crystal X-ray diffraction and high-resolution transmission electron microscopy Acta Crystallographica Section B, 1996, 52, 961-965 |
| 1001202 | CIF | La6 O18 Re4 | P -1 | 6.858; 11.198; 5.673 105.32; 111.17; 92.94 | 386.6 | Besse, J P; Baud, G; Chevalier, R; Gasperin, M Structure Cristalline d'Oxydes Doubles de Rhenium. II.L'Oxyde de Lanthane-Rhenium La~6~ Re~4~ O~18~ Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3532-3535 |
| 2100452 | CIF Paper | C6 Cl4 D2 | P 1 21/n 1 | 3.85595; 10.61473; 9.59283 90; 99.6884; 90 | 387.033 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
| 2107250 | CIF | D12 N6 Ni O4 | C 1 2/m 1 | 10.647; 6.799; 5.891 90; 114.82; 90 | 387.053 | Iversen, B.B.; Larsen, F.K.; Reynolds, P.A.; Figgis, B.N.; Schultz, A.J. Atomic displacement parameters for Ni (N D3)4 (N O2)2 from 9 K x-ray and 13 K time-of-flight neutron diffraction data Acta Crystallographica B (39,1983-), 1996, 52, 923-931 |
| 2104767 | CIF HKL Paper | Bi2 Ga4 O9 | P b a m | 7.9264; 8.2922; 5.8892 90; 90; 90 | 387.08 | Friedrich, Alexandra; Juarez-Arellano, Erick A.; Haussühl, Eiken; Boehler, Reinhard; Winkler, Björn; Wiehl, Leonore; Morgenroth, Wolfgang; Burianek, Manfred; Mühlberg, Manfred Persistence of the stereochemical activity of the Bi^3+^ lone electron pair in Bi~2~Ga~4~O~9~ up to 50GPa and crystal structure of the high-pressure phase Acta Crystallographica Section B, 2010, 66, 323-337 |
| 2104357 | CIF Paper | Ba O11 V6 | P 63/m m c | 5.797; 5.797; 13.301 90; 90; 120 | 387.1 | Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~ Acta Crystallographica Section B, 2009, 65, 326-333 |
| 9007559 | CIF | N Na O3 | R -3 c :H | 5.082; 5.082; 17.31 90; 90; 120 | 387.166 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 268 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007566 | CIF | N Na O3 | R -3 c :H | 5.082; 5.082; 17.31 90; 90; 120 | 387.166 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 268 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 2104725 | CIF Paper | O3 Pb Sc0.5 Ta0.5 | R -3 c :H | 5.6828; 5.68276; 13.8439 90; 90; 120 | 387.18 | Maier, Bernd J.; Angel, Ross J.; Marshall, William G.; Mihailova, Boriana; Paulmann, Carsten; Engel, Jens M.; Gospodinov, Marin; Welsch, Anna-Maria; Petrova, Dimitrina; Bismayer, Ulrich Octahedral tilting in Pb-based relaxor ferroelectrics at high pressure Acta Crystallographica Section B, 2010, 66, 280-291 |
| 2107188 | CIF | Ca2 H15 N O18 P4 | P -1 | 5.693; 12.299; 6.297 103.98; 115.1; 84.22 | 387.442 | Takagi, S.; Mathew, M.; Brown, W.E. Phosphate Ion with Three-Symmetric-Hydrogen Bonds: The Structure of Ca2 (N H4 H7 (P O4)4 (H2 O)2 Acta Crystallographica B (24,1968-38,1982), 1980, 36, 766-771 |
| 2100497 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.6343; 5.6073; 9.5122 90; 107.911; 90 | 387.46 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
| 2107101 | CIF | Cr Na2 O4 | C m c m | 5.862; 9.251; 7.145 90; 90; 90 | 387.469 | Nimmo, J.K. Sodium chromate(VI) at 296 K (neutron) Acta Crystallographica B (24,1968-38,1982), 1981, 37, 431-433 |
| 2104785 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.6729; 5.671; 12.047 90; 90; 90 | 387.6 | Tumanov, N. A.; Boldyreva, E. V.; Kolesov, B. A.; Kurnosov, A. V.; Quesada Cabrera, R. Pressure-induced phase transitions in <small>L</small>-alanine, revisited Acta Crystallographica Section B, 2010, 66, 458-471 |
| 2104247 | CIF Paper | C9 H10 O2 | P 1 21 1 | 6.3758; 7.1703; 8.6281 90; 100.64; 90 | 387.66 | Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A. Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide Acta Crystallographica Section B, 2008, 64, 780-790 |
| 2106121 | CIF | La2 Sb | I 4/m m m | 4.629; 4.629; 18.098 90; 90; 90 | 387.797 | Wang, Y.; Taylor, J.B.; Calvert, L.D. Is there an oxygen atom in La2 Sb Acta Crystallographica B (24,1968-38,1982), 1980, 36, 220-221 |
| 2104833 | CIF Paper | Cl2 H4 Mg O10 | C 1 2/m 1 | 14.38776; 5.21861; 5.43805 90; 108.199; 90 | 387.89 | Robertson, Kevin; Bish, David Determination of the crystal structure of magnesium perchlorate hydrates by X-ray powder diffraction and the charge-flipping method Acta Crystallographica Section B, 2010, 66, 579-584 |
| 2003130 | CIF HKL Paper | Al Li O6 Si2 | C 1 2/c 1 | 9.456; 8.386; 5.216 90; 110.13; 90 | 388.35 | Kuntzinger, Sandrine; Ghermani, Nour Eddine Electron density distribution and Madelung potential in α-spodumene, LiAl(SiO~3~)~2~, from two-wavelength high-resolution X-ray diffraction data Acta Crystallographica Section B, 1999, 55, 273-284 |
| 2100269 | CIF Paper | C4 H8 O | P n a 21 | 4.9208; 8.2302; 9.598 90; 90; 90 | 388.71 | Dave Allan, D The low-temperature and high-pressure crystal structures of cyclobutanol (C~4~H~7~OH) Acta Crystallographica Section B, 2005, 61, 449-454 |
| 2108019 | CIF HKL | H O4 Rb S | P 1 21/c 1 | 7.3202; 7.765; 7.3247 90; 110.938; 90 | 388.85 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2104732 | CIF Paper | Ba0.23 O3 Pb0.77 Sc0.5 Ta0.5 | R -3 c :H | 5.6797; 5.6797; 13.919 90; 90; 120 | 388.86 | Maier, Bernd J.; Angel, Ross J.; Marshall, William G.; Mihailova, Boriana; Paulmann, Carsten; Engel, Jens M.; Gospodinov, Marin; Welsch, Anna-Maria; Petrova, Dimitrina; Bismayer, Ulrich Octahedral tilting in Pb-based relaxor ferroelectrics at high pressure Acta Crystallographica Section B, 2010, 66, 280-291 |
| 2003129 | CIF HKL Paper | Al Li O6 Si2 | C 1 2/c 1 | 9.462; 8.392; 5.221 90; 110.18; 90 | 389.12 | Kuntzinger, Sandrine; Ghermani, Nour Eddine Electron density distribution and Madelung potential in α-spodumene, LiAl(SiO~3~)~2~, from two-wavelength high-resolution X-ray diffraction data Acta Crystallographica Section B, 1999, 55, 273-284 |
| 2105417 | CIF | B Nb Ni2 O6 | P n m a | 10.057; 8.618; 4.49 90; 90; 90 | 389.154 | Modrick, M.A.; Ansell, G.B.; Wondre, F.R.; Wanklyn, B.M.; Leonowicz, M.E. The Structure of Dinickel Niobium(V) Boron Oxide Ni2 Nb B O6 Acta Crystallographica B (24,1968-38,1982), 1982, 38, 892-893 |
| 2107055 | CIF | Ba Fe O2.67 | P 63/m m c | 5.683; 5.683; 13.916 90; 90; 120 | 389.225 | Lucchini, E.; Meriani, S.; Minichelli, D. An X-ray study of two phases of Ba Fe O3-x Acta Crystallographica B (24,1968-38,1982), 1973, 29, 1217-1219 |
| 2106143 | CIF | Cr2 Ru | P 42/m n m | 9.0635; 9.0635; 4.743 90; 90; 90 | 389.623 | D'Alte da Veiga, L.M.; Andrade, L.R.; Costa, M.M.R.; de Almeida, M.J.M.; Matos Beja, A. The ordering of the sigma-phases Cr2 Ru and Cr2 Os Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1750-1757 |
| 2100241 | CIF Paper | C3 H7 N O3 | P 21 21 21 | 8.298; 8.6; 5.4663 90; 90; 90 | 390.09 | Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa Acta Crystallographica Section B, 2005, 61, 58-68 |
| 2100592 | CIF Paper | C3 D7 N O3 | P 21 21 21 | 8.3096; 8.595; 5.4647 90; 90; 90 | 390.29 | S. A. Moggach; W. G. Marshall; S. Parsons High-pressure neutron diffraction study of L-serine-I and L-serine-II, and the structure of L-serine-III at 8.1 GPa Acta Crystallographica, Section B, 2006, 62, 815-825 |
| 2002984 | CIF Paper | Fe2 Ho | F d -3 m :2 | 7.3091; 7.3091; 7.3091 90; 90; 90 | 390.47 | Streltsov V. A. Synchrotron X-ray analysis of the electron density in HoFe~2~ Acta Crystallographica Section B, 1999, 55, 321-326 |
| 2106698 | CIF | Ga Se | P 63 m c | 3.755; 3.755; 31.99 90; 90; 120 | 390.629 | Kuhn, A.; Chevalier, R.; Rimsky, A. Atomic structure of a 4H Ga Se polytype named delta-type Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2841-2842 |
| 2105147 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.77; 5.751; 5.7748 90; 90; 90 | 390.9 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2105103 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.7505; 8.6644; 9.725 90; 102.35; 90 | 391 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 1001110 | CIF | Ca Cl2 H8 O4 | P 1 21/c 1 | 6.1387; 7.6669; 8.9014 90; 111; 90 | 391.1 | Leclaire, A.; Borel, M. M.; Monier, J. C. La Forme γ du Dichlorure de Calcium Tetrahydrate Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2757-2759 |
| 2104724 | CIF Paper | O3 Pb Sc0.5 Ta0.5 | R -3 c :H | 5.7001; 5.7001; 13.901 90; 90; 120 | 391.15 | Maier, Bernd J.; Angel, Ross J.; Marshall, William G.; Mihailova, Boriana; Paulmann, Carsten; Engel, Jens M.; Gospodinov, Marin; Welsch, Anna-Maria; Petrova, Dimitrina; Bismayer, Ulrich Octahedral tilting in Pb-based relaxor ferroelectrics at high pressure Acta Crystallographica Section B, 2010, 66, 280-291 |
| 2100883 | CIF Paper | C8 H26 Cu N4 O6 | P -1 | 5.055; 7.012; 11.768 80.32; 79.92; 73.77 | 391.2 | Prout, K.; Mtetwa, V. S. B.; Rossotti, F. J. C. Structure and stability of carboxylate complexes. XIX. The structures of diamminebis(glycolato)copper(II), tetraamminebis(ethoxyacetato)copper(II), bis(glycolato)bis(pyridine)copper(II) and bis(ethoxyacetato)bis(pyridine)copper(II) Acta Crystallographica Section B, 1993, 49, 73-79 |
| 2104176 | CIF HKL Paper | C3 H9 N O | C 1 c 1 | 5.8288; 8.052; 8.343 90; 91.67; 90 | 391.4 | Gajda, Roman; Katrusiak, Andrzej Pressure-freezing with conformational conversion of 3-aminopropan-1-ol molecules Acta Crystallographica Section B, 2008, 64, 476-482 |
| 2105427 | CIF | B50 V1.54 | P 42/n n m :1 | 8.824; 8.824; 5.027 90; 90; 90 | 391.417 | Polborn, K.; Amberger, E. Tetragonales Vanadiumborid (B12)4 B2 V1.5-1.9 Acta Crystallographica B (24,1968-38,1982), 1976, 32, 974-975 |
| 2100496 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.6626; 5.6223; 9.5448 90; 107.815; 90 | 391.49 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
| 2105085 | CIF HKL Paper | C18 H12 N4 O4 | P -1 | 4.53125; 5.99235; 14.7567 88.2562; 81.6029; 81.2337 | 391.747 | Vella-Zarb, Liana; Dinnebier, Robert E. Form, function and functionality of two dimeric toluene-2,4-diisocyanate polymorphs Acta Crystallographica Section B, 2012, 68, 204-208 |
| 2022070 | CIF | C5 H13 Cl N2 O2 | P 1 21 1 | 9.948; 7.9637; 4.9826 90; 83.13; 90 | 391.902 | Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76 |
| 2102846 | CIF HKL Paper | C5 H13 Cl N2 O2 | P 1 21 1 | 9.948; 7.9637; 4.9826 90; 83.13; 90 | 391.902 | Dittrich, B.; Munshi, P.; Spackman, M. A. Redetermination, invariom-model and multipole refinement of <small>L</small>-ornithine hydrochloride Acta Crystallographica Section B, 2007, 63, 505-509 |
| 2104723 | CIF Paper | O3 Pb Sc0.5 Ta0.5 | R -3 c :H | 5.7002; 5.7002; 13.935 90; 90; 120 | 392.12 | Maier, Bernd J.; Angel, Ross J.; Marshall, William G.; Mihailova, Boriana; Paulmann, Carsten; Engel, Jens M.; Gospodinov, Marin; Welsch, Anna-Maria; Petrova, Dimitrina; Bismayer, Ulrich Octahedral tilting in Pb-based relaxor ferroelectrics at high pressure Acta Crystallographica Section B, 2010, 66, 280-291 |
| 2107219 | CIF | C K2 O3 | C 1 2/c 1 | 5.675; 9.92; 7.018 90; 96.8; 90 | 392.306 | Becht, H.Y.; Struikmans, R. A monoclinic high-temperature modification of potassium carbonate Acta Crystallographica B (24,1968-38,1982), 1976, 32, 3344-3346 |
| 2104168 | CIF HKL Paper | C18 H12 N2 O4 | P -1 | 5.784; 7.3241; 10.229 106.26; 105.3; 96.55 | 392.9 | Rychlewska, Urszula; Waścinska, Natalia; Warżajtis, Beata; Gawroński, Jacek Role of the <i>gauche</i> effect and local 1,3-dipole‒dipole interactions in stabilizing an unusual conformation of tartarodinitriles Acta Crystallographica Section B, 2008, 64, 497-503 |
| 2101478 | CIF Paper | Al Fe O3 | P n a 21 | 4.9792; 8.5466; 9.2345 90; 90; 90 | 392.976 | Bouree, F.; Baudour, J. L.; Elbadraoui, E.; Musso, J.; Laurent, C.; Rousset, A. Crystal and magnetic structure of piezoelectric, ferrimagnetic and magnetoelectric aluminium iron oxide FeAlO~3~ from neutron powder diffraction Acta Crystallographica Section B, 1996, 52, 217-222 |
| 2104248 | CIF Paper | C9 H10 O2 | P 1 21 1 | 6.428; 7.1935; 8.6507 90; 100.41; 90 | 393.42 | Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A. Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide Acta Crystallographica Section B, 2008, 64, 780-790 |
| 2106871 | CIF | H8 Na4 O14 Te4 | P -1 | 11.632; 5.613; 6.193 102.51; 93.14; 92.23 | 393.616 | Daniel, F.; Moret, J.; Maurin, M.; Philippot, E. Etude Cristallographique du Tellurite de Sodium a Deux Molecules d'Eau, Na2 Te2 O5 (H2 O)2 Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1278-1281 |
| 2106688 | CIF | H4 Hg2 N2 O8 | P 1 21/n 1 | 8.633; 7.506; 6.256 90; 103.8; 90 | 393.683 | Grdenic, D.; Sikirica, M.; Vickovic, I. A redetermination of the crystal structure of mercury(I) nitrate dihydrate Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2174-2175 |
| 2106866 | CIF | Cr Cs I3 | P 63/m m c | 8.107; 8.107; 6.917 90; 90; 120 | 393.703 | Crama, W.J.; Zandbergen, H.W. The Jahn-Teller Effect in the Structures of Cesium Chromium(II) Trichloride and Cesium Chromium(II) Triiodide Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1027-1031 |
| 2106985 | CIF | Al2 Ni3 O8 Si | P m m a | 5.661; 8.59; 8.097 90; 90; 90 | 393.741 | Horioka, K.; Morimoto, N.; Nishiguchi, M.; Horiuchi, H.; Wkaogi, M.; Akimoto, S.I. Structure of Nickel Aluminosilicate (Phase V): A High-Pressure Phase Related to Spinel Acta Crystallographica B (24,1968-38,1982), 1981, 37, 638-640 |
| 2103563 | CIF HKL Paper | C5 H13 Cl N2 O | P 1 21 1 | 5.3377; 7.4572; 9.899 90; 91.73; 90 | 393.84 | In, Yasuko; Fujii, Mayumi; Sasada, Yasuhiro; Ishida, Toshimasa Structural studies on C-amidated amino acids and peptides: structures of hydrochloride salts of C-amidated Ile, Val, Thr, Ser, Met, Trp, Gln and Arg, and comparison with their C-unamidated counterparts Acta Crystallographica Section B, 2001, 57, 72-81 |
| 2106910 | CIF | Ce4 O4 S3 | P b a m | 6.851; 14.529; 3.958 90; 90; 90 | 393.972 | Dugue, J.; Guittard, M.; Carre, D. Etude structurale des oxysulfures de cerium(III) et cerium (IV). I. Structure cristalline de l'oxysulfure de cerium Ce4 O4 S3 Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3564-3568 |
| 2101477 | CIF Paper | Al Fe O3 | P n a 21 | 4.9839; 8.5544; 9.2413 90; 90; 90 | 393.996 | Bouree, F.; Baudour, J. L.; Elbadraoui, E.; Musso, J.; Laurent, C.; Rousset, A. Crystal and magnetic structure of piezoelectric, ferrimagnetic and magnetoelectric aluminium iron oxide FeAlO~3~ from neutron powder diffraction Acta Crystallographica Section B, 1996, 52, 217-222 |
| 2107396 | CIF | C H6 N4 O | P 1 21/c 1 | 3.728; 8.841; 12.659 90; 109.1; 90 | 394.262 | Domiano, P.; Pellinghelli, M.A.; Tiripicchio, A. Crystal and molecular structure of carbohydrazide Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2495-2498 |
| 2100376 | CIF Paper | C7 H7 Br N2 O | P -1 | 7.269; 7.709; 8.403 67.01; 68.03; 72 | 394.61 | Plutecka, A.; Hoffmann, M.; Rychlewska, U.; Kucybała, Z.; Pączkowski, J.; Pyszka, I. Relationship between structure and photoinitiating abilities of selected bromide salts of 2-oxo-2,3-dihydro-1<i>H</i>-imidazo[1,2-<i>a</i>]pyridine (IMP): influence of the solvent and the substitution in benzaldehyde on the course of its reaction with IMP Acta Crystallographica Section B, 2006, 62, 135-142 |
| 2105846 | CIF HKL | C3 H7 N O2 | P 21 21 21 | 5.956; 7.8277; 8.4702 90; 90; 90 | 394.9 | Kapustin, Eugene A.; Minkov, Vasily S.; Boldyreva, Elena V. Effect of pressure on methylated glycine derivatives: relative roles of hydrogen bonds and steric repulsion of methyl groups Acta Crystallographica Section B, 2014, 70, 517-532 |
| 2108207 | CIF | C4 H4 O4 | P b c a | 4.8571; 7.1033; 11.4462 90; 90; 90 | 394.91 | Hutchison, Ian B.; Bull, Craig L.; Marshall, William G.; Parsons, Simon; Urquhart, Andrew J.; Oswald, Iain D. H. Compression of glycolide-h~4~ to 6GPa Acta Crystallographica Section B, 2017, 73, 1151-1157 |
| 2101932 | CIF Paper | C10 H10 Fe | P 1 21/a 1 | 10.443; 7.572; 5.824 90; 120.95; 90 | 395 | Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B, 1997, 53, 928-938 |
| 2101934 | CIF Paper | C10 H10 Fe | P 1 21/a 1 | 10.443; 7.572; 5.824 90; 120.95; 90 | 395 | Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B, 1997, 53, 928-938 |
| 2101936 | CIF Paper | C10 H10 Fe | P 1 21/a 1 | 10.443; 7.572; 5.824 90; 120.95; 90 | 395 | Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B, 1997, 53, 928-938 |
| 2105111 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 5.489; 8.339; 8.632 90; 90; 90 | 395.1 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2103958 | CIF HKL Paper | C4 H12 Cl N O4 | P 4/n m m :2 | 8.2376; 8.2376; 5.8256 90; 90; 90 | 395.31 | Palacios, Elías; Burriel, Ramón; Ferloni, Paolo The phases of [(CH~3~)~4~N](ClO~4~) at low temperature Acta Crystallographica Section B, 2003, 59, 625-633 |
| 2105426 | CIF | B50 Ti1.87 | P 42/n n m :1 | 8.83; 8.83; 5.072 90; 90; 90 | 395.458 | Amberger, E.; Polbov, K. Struktur des tetragonalen (B12)4 B2 Ti1.3...2.0 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 949-953 |
| 9007586 | CIF | As2 Fe H5 O10 Pb Zn | C 1 2/m 1 | 9.124; 6.329; 7.577 90; 115.28; 90 | 395.637 | Tillmanns, E.; Gebert, W. The crystal structure of tsumcorite, a new mineral from the Tsumeb Mine, S.W. Africa Locality: Tsumeb mine, Namibia, Africa Acta Crystallographica, Section B, 1973, 29, 2789-2794 |
| 2105146 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.7991; 5.7917; 5.79 90; 90; 90 | 395.67 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2100240 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 8.3266; 8.665; 5.4851 90; 90; 90 | 395.75 | Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa Acta Crystallographica Section B, 2005, 61, 58-68 |
| 2104722 | CIF Paper | O3 Pb Sc0.5 Ta0.5 | R -3 c :H | 5.7147; 5.7147; 13.996 90; 90; 120 | 395.84 | Maier, Bernd J.; Angel, Ross J.; Marshall, William G.; Mihailova, Boriana; Paulmann, Carsten; Engel, Jens M.; Gospodinov, Marin; Welsch, Anna-Maria; Petrova, Dimitrina; Bismayer, Ulrich Octahedral tilting in Pb-based relaxor ferroelectrics at high pressure Acta Crystallographica Section B, 2010, 66, 280-291 |
| 2101588 | CIF Paper | K2 O7 Zn6 | P 42 n m | 10.912; 10.912; 3.325 90; 90; 90 | 395.914 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101306 | CIF Paper | Al2 O4 Pb | A m a 2 | 8.458; 9.234; 5.07 90; 90; 90 | 395.973 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2105102 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.7576; 8.7046; 9.785 90; 102.25; 90 | 396 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2106304 | CIF | F H4 Li N O3 P | P 1 21/c 1 | 5.463; 5.049; 14.362 90; 90.82; 90 | 396.102 | Durand, J.; le Cot, L.; Galigne, J.L. Etudes structurales de composes oxyfluores du P(V). V. Structure cristalline de Li N H4 P O3 F Acta Crystallographica B (24,1968-38,1982), 1978, 34, 388-391 |
| 2106761 | CIF | Ag Er Se2 | P 21 21 21 | 6.88; 13.79; 4.18 90; 90; 90 | 396.578 | Julien-Pouzol, M.; Laruelle, P. Structure cristalline de Er Ag Se2 Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1510-1512 |
| 2104731 | CIF Paper | Ba0.23 O3 Pb0.77 Sc0.5 Ta0.5 | R -3 c :H | 5.7209; 5.7209; 14.016 90; 90; 120 | 397.27 | Maier, Bernd J.; Angel, Ross J.; Marshall, William G.; Mihailova, Boriana; Paulmann, Carsten; Engel, Jens M.; Gospodinov, Marin; Welsch, Anna-Maria; Petrova, Dimitrina; Bismayer, Ulrich Octahedral tilting in Pb-based relaxor ferroelectrics at high pressure Acta Crystallographica Section B, 2010, 66, 280-291 |
| 2100609 | CIF Paper | Al Ca Si | P -6 m 2 | 4.1772; 4.1772; 26.3246 90; 90; 120 | 397.8 | K. M. Sparta; R. Müller; M. Merz; G. Roth; P. Adelmann; T. Wolf Modulated corrugations in the crystal structure of the superconductor CaAlSi Acta Crystallographica, Section B, 2006, 62, 710-718 |
| 2003025 | CIF Paper | Fe H2 O5 Se | C 1 2/c 1 | 7.14; 8.05; 7.84 90; 118.1; 90 | 398 | Aleksovska, S.; Petrusevski, V. M.; Soptrajanov, B. Calculation of Structural Parameters in Isostructural Series: the Kieserite Group Acta Crystallographica Section B, 1998, 54, 564-567 |
| 2104981 | CIF HKL Paper | C H4 Li O3 P | P 1 21/c 1 | 9.267; 4.604; 9.384 90; 96.12; 90 | 398.1 | Mermer, Adrian; Starynowicz, Przemysław Charge-density distribution in hydrogen methylphosphonates of calcium and lithium Acta Crystallographica Section B, 2011, 67, 399-408 |
| 2107264 | CIF | Ca O5 Si Ti | P 1 21/a 1 | 7.278; 8.856; 6.858 90; 115.75; 90 | 398.131 | Kunz, M.; Armbruster, T. Applications and limitations of the ionic potential model with empirically derived ion-specific repulsion parameters Acta Crystallographica B (39,1983-), 1992, 48, 609-622 |
| 2002966 | CIF Paper | C2 H2 F3 N O | P 21 21 21 | 4.547; 5.947; 14.731 90; 90; 90 | 398.3 | Perpetuo, Genivaldo; Buschmann, Jürgen; Luger, Peter; Lentz, Dieter; Dreissig, D. Low-temperature crystallization and structure determination of <i>N</i>-(trifluoromethyl)formamide, <i>N</i>-(2,2,2-trifluoroethyl)formamide and 2,2,2-trifluoroethyl isocyanide Acta Crystallographica Section B, 1999, 55, 70-77 |
| 2104721 | CIF Paper | O3 Pb Sc0.5 Ta0.5 | R -3 c :H | 5.7275; 5.7275; 14.024 90; 90; 120 | 398.41 | Maier, Bernd J.; Angel, Ross J.; Marshall, William G.; Mihailova, Boriana; Paulmann, Carsten; Engel, Jens M.; Gospodinov, Marin; Welsch, Anna-Maria; Petrova, Dimitrina; Bismayer, Ulrich Octahedral tilting in Pb-based relaxor ferroelectrics at high pressure Acta Crystallographica Section B, 2010, 66, 280-291 |
| 2106944 | CIF | Pb S | C 1 2/m 1 | 5.881; 5.8; 11.759 90; 95.27; 90 | 399.402 | van Smaalen, S.; Meetsma, A.; de Boer, J.L.; Wiegers, G.A. Determination of the modulated structure of the inorganic misfit layer compound (Pb S)1.18 Ti S2 Acta Crystallographica B (39,1983-), 1991, 47, 314-325 |
| 2103313 | CIF Paper | Ge Li O5 Ta | P 1 21/c 1 | 7.584; 8.0849; 7.508 90; 119.69; 90 | 399.9 | Malcherek, Thomas Structure and phase transitions of LiTaOGeO~4~ Acta Crystallographica Section B, 2002, 58, 607-612 |
| 2104784 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.6999; 5.772; 12.161 90; 90; 90 | 400.1 | Tumanov, N. A.; Boldyreva, E. V.; Kolesov, B. A.; Kurnosov, A. V.; Quesada Cabrera, R. Pressure-induced phase transitions in <small>L</small>-alanine, revisited Acta Crystallographica Section B, 2010, 66, 458-471 |
| 2106048 | CIF | Cu1.82 O11 V4 | C 1 m 1 | 15.38; 3.61; 7.37 90; 102; 90 | 400.254 | Galy, J.; Lavaud, D. Structure cristalline du Bronze de Vanadium Cu1.82 V4 O11 Acta Crystallographica B (24,1968-38,1982), 1971, 27, 1005-1009 |
| 9015119 | CIF | N4 O14 P2 Te | P -1 | 11.51; 6.484; 6.329 118.15; 105.8; 84.36 | 400.48 | Durif, A.; Averbuch-Pouchot, M. T.; Guitel, J. C. Structures de deux phosphotellurates. Te(OH)6((NH4)2HPO4)2 and Te(OH)6(Na2HPO4)(H2O) Acta Crystallographica, Section B, 1979, 35, 1444-1447 |
| 1007037 | CIF | H24 N4 O14 P2 Te | P -1 | 11.51; 6.484; 6.329 118.15; 105.8; 84.36 | 400.5 | Durif, A; Averbuch-Pouchot, M T; Guitel, J C Structures de deux phosphotellurates. Te (O H)~6~ ((N H~4~)~2~ H P O~4~)~2~ Te (O H)~6~ (Na~2~ H P O~4~) (H~2~ O) Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1444-1447 |
| 2104175 | CIF HKL Paper | C3 H9 N O | C 1 c 1 | 5.853; 8.123; 8.428 90; 91.99; 90 | 400.5 | Gajda, Roman; Katrusiak, Andrzej Pressure-freezing with conformational conversion of 3-aminopropan-1-ol molecules Acta Crystallographica Section B, 2008, 64, 476-482 |
| 2104720 | CIF Paper | O3 Pb Sc0.5 Ta0.5 | R -3 c :H | 5.7374; 5.7374; 14.056 90; 90; 120 | 400.7 | Maier, Bernd J.; Angel, Ross J.; Marshall, William G.; Mihailova, Boriana; Paulmann, Carsten; Engel, Jens M.; Gospodinov, Marin; Welsch, Anna-Maria; Petrova, Dimitrina; Bismayer, Ulrich Octahedral tilting in Pb-based relaxor ferroelectrics at high pressure Acta Crystallographica Section B, 2010, 66, 280-291 |
| 2103314 | CIF HKL Paper | Ge Li O5 Ta | C 1 2/c 1 | 7.5773; 8.1188; 7.491 90; 119.545; 90 | 400.913 | Malcherek, Thomas Structure and phase transitions of LiTaOGeO~4~ Acta Crystallographica Section B, 2002, 58, 607-612 |
| 2103315 | CIF HKL Paper | Ge Li O5 Ta | C 1 2/c 1 | 7.5773; 8.1188; 7.491 90; 119.545; 90 | 400.913 | Malcherek, Thomas Structure and phase transitions of LiTaOGeO~4~ Acta Crystallographica Section B, 2002, 58, 607-612 |
| 2106843 | CIF | Cr I2 | C m c 21 | 3.915; 7.56; 13.553 90; 90; 90 | 401.134 | Besrest, F.; Jaulmes, S. Structure cristalline de l'iodure de chrome: Cr I2 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 1560-1563 |
| 2102115 | CIF Paper | ? | F d -3 m :2 | 7.37515; 7.375154; 7.375154 90; 90; 90 | 401.156 | Zhao, Yusheng; Chu, Fuming; Von Dreele, Robert B.; Zhu, Qing Structural phase transitions of HfV~2~ at low temperatures Acta Crystallographica Section B, 2000, 56, 601-606 |
| 2105845 | CIF HKL | C3 H7 N O2 | P 21 21 21 | 6; 7.8498; 8.5198 90; 90; 90 | 401.27 | Kapustin, Eugene A.; Minkov, Vasily S.; Boldyreva, Elena V. Effect of pressure on methylated glycine derivatives: relative roles of hydrogen bonds and steric repulsion of methyl groups Acta Crystallographica Section B, 2014, 70, 517-532 |
| 2107199 | CIF | H2 I3 K O | P 1 c 1 | 4.629; 10.047; 9.662 90; 116.51; 90 | 402.109 | Thomas, R.; Moore, F.H. Neutron Diffraction Studies of Polyiodides. I. Potassium Triiodide Monohydrate Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2869-2873 |
| 2105101 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.7708; 8.7429; 9.864 90; 102.14; 90 | 402.2 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 1008037 | CIF | H K O8 P2 Zn2 | P -1 | 9.432; 8.907; 5.22 72.67; 78.33; 76.09 | 402.3 | Averbuch-Pouchot, M T Structure du monophosphate acide de potassium-zinc. K Zn~2~ H (P O~4~)~2~ Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1452-1454 |
| 2104719 | CIF Paper | O3 Pb Sc0.5 Ta0.5 | R -3 c :H | 5.7444; 5.7444; 14.078 90; 90; 120 | 402.31 | Maier, Bernd J.; Angel, Ross J.; Marshall, William G.; Mihailova, Boriana; Paulmann, Carsten; Engel, Jens M.; Gospodinov, Marin; Welsch, Anna-Maria; Petrova, Dimitrina; Bismayer, Ulrich Octahedral tilting in Pb-based relaxor ferroelectrics at high pressure Acta Crystallographica Section B, 2010, 66, 280-291 |
| 2105869 | CIF HKL | C5 H5 N O | P 41 21 2 | 5.498; 5.498; 13.334 90; 90; 90 | 403.06 | Patyk, Ewa; Marciniak, Jedrzej; Tomkowiak, Hanna; Katrusiak, Andrzej; Merz, Klaus Isothermal and isochoric crystallization of highly hygroscopic pyridine <i>N</i>-oxide of aqueous solution Acta Crystallographica Section B, 2014, 70, 487-491 |
| 2100495 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.7447; 5.6735; 9.6219 90; 107.559; 90 | 403.08 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
| 1007266 | CIF | K Na2 O9 P3 | P -1 | 6.886; 9.494; 6.797 110.07; 104.69; 86.68 | 403.5 | Tordjman, I; Durif, A; Cavero-Ghersi, C Structure cristalline du trimetaphosphate de sodiumpotassium: N A K P3 O9 Acta Crystallographica B (24,1968-38,1982), 1974, 30, 2701-2704 |
| 2104718 | CIF Paper | O3 Pb Sc0.5 Ta0.5 | R -3 c :H | 5.7515; 5.7515; 14.095 90; 90; 120 | 403.79 | Maier, Bernd J.; Angel, Ross J.; Marshall, William G.; Mihailova, Boriana; Paulmann, Carsten; Engel, Jens M.; Gospodinov, Marin; Welsch, Anna-Maria; Petrova, Dimitrina; Bismayer, Ulrich Octahedral tilting in Pb-based relaxor ferroelectrics at high pressure Acta Crystallographica Section B, 2010, 66, 280-291 |
| 2104839 | CIF Paper | C6 H2 Cl3 N3 | P 1 21 1 | 3.7715; 13.1451; 8.3333 90; 102.138; 90 | 403.902 | Takayama, Terufumi; Mitsumori, Takahiro; Kawano, Masaki; Sekine, Akiko; Uekusa, Hidehiro; Ohashi, Yuji; Sugawara, Tadashi Direct observation of arylnitrene formation in the photoreaction of arylazide crystals Acta Crystallographica Section B, 2010, 66, 639-646 |
| 2105145 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.852; 5.8715; 5.8057 90; 90; 90 | 404.01 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2003027 | CIF Paper | Li2 O5 Si2 | C c c 2 | 5.807; 14.582; 4.773 90; 90; 90 | 404.2 | de Jong, B. H. W. S.; Supèr, H. T. J.; Spek, A. L.; Veldman, N.; Nachtegaal, G.; Fischer, J. C. Mixed Alkali Systems: Structure and ^29^Si MASNMR of Li~2~Si~2~O~5~ and K~2~Si~2~O~5~ Acta Crystallographica Section B, 1998, 54, 568-577 |
| 2101698 | CIF Paper | Mg Na2 O4 Si | P n a 21 | 10.835; 5.279; 7.067 90; 90; 90 | 404.2 | Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterisation of Three New Cristobalite-related Sodium Magnesiosilicates Acta Crystallographica, Section B, 1997, 53, 203-220 |
| 2101699 | CIF Paper | Mg Na2 O4 Si | P n a 21 | 10.835; 5.279; 7.067 90; 90; 90 | 404.2 | Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterisation of Three New Cristobalite-related Sodium Magnesiosilicates Acta Crystallographica, Section B, 1997, 53, 203-220 |
| 2101700 | CIF Paper | Mg Na2 O4 Si | P n a 21 | 10.835; 5.279; 7.067 90; 90; 90 | 404.2 | Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterisation of Three New Cristobalite-related Sodium Magnesiosilicates Acta Crystallographica, Section B, 1997, 53, 203-220 |
| 2101701 | CIF Paper | Mg Na2 O4 Si | P n a 21 | 10.835; 5.279; 7.067 90; 90; 90 | 404.2 | Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterisation of Three New Cristobalite-related Sodium Magnesiosilicates Acta Crystallographica, Section B, 1997, 53, 203-220 |
| 2100239 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 8.3702; 8.7699; 5.5103 90; 90; 90 | 404.49 | Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa Acta Crystallographica Section B, 2005, 61, 58-68 |
| 2102962 | CIF HKL Paper | C2 H2 Cl2 O2 | P 1 21/n 1 | 4.563; 10.978; 8.087 90; 92.6; 90 | 404.7 | Roman Gajda; Andrzej Katrusiak Compressed hydrogen-bond effects in the pressure-frozen chloroacetic acid Acta Crystallographica Section B, 2007, 63, 896-902 |
| 2104978 | CIF Paper | C6 H4 S2 Tl2 | P -1 | 6.5525; 6.8444; 9.5265 71.798; 85.988; 89.219 | 404.86 | Stone, Kevin H.; Turner, Dayna L.; Singh, Mayank Pratap; Vaid, Thomas P.; Stephens, Peter W. Hidden superlattice in Tl~2~(SC~6~H~4~S) and Tl~2~(SeC~6~H~4~Se) solved from powder X-ray diffraction Acta Crystallographica Section B, 2011, 67, 409-415 |
| 2104145 | CIF HKL Paper | Ca2 Ge O4 | P n m a | 11.3919; 6.78; 5.2424 90; 90; 90 | 404.91 | Redhammer, Günther J.; Roth, Georg; Amthauer, Georg; Lottermoser, Werner On the crystal chemistry of olivine-type germanate compounds, Ca~1+<i>x~</i><i>M</i>~1{-~<i>x</i>}GeO~4~ (<i>M</i>^2+^ = Ca, Mg, Co, Mn) Acta Crystallographica Section B, 2008, 64, 261-271 |
| 2104146 | CIF HKL Paper | Ca2 Ge O4 | P n m a | 11.3919; 6.78; 5.2424 90; 90; 90 | 404.91 | Redhammer, Günther J.; Roth, Georg; Amthauer, Georg; Lottermoser, Werner On the crystal chemistry of olivine-type germanate compounds, Ca~1+<i>x~</i><i>M</i>~1{-~<i>x</i>}GeO~4~ (<i>M</i>^2+^ = Ca, Mg, Co, Mn) Acta Crystallographica Section B, 2008, 64, 261-271 |
| 2104154 | CIF HKL Paper | Ca2 Ge O4 | P n m a | 11.3923; 6.7854; 5.2388 90; 90; 90 | 404.97 | Redhammer, Günther J.; Roth, Georg; Amthauer, Georg; Lottermoser, Werner On the crystal chemistry of olivine-type germanate compounds, Ca~1+<i>x~</i><i>M</i>~1{-~<i>x</i>}GeO~4~ (<i>M</i>^2+^ = Ca, Mg, Co, Mn) Acta Crystallographica Section B, 2008, 64, 261-271 |
| 2100427 | CIF Paper | Ba Ni0.105 O2.686 Rh0.791 | X-3c1(00\g)000 | 10.0576; 10.0576; 4.6306 90; 90; 120 | 405.65 | Schönleber, Andreas; Zúñiga, F. Javier; Perez-Mato, J. Manuel; Darriet, Jacques; zur Loye, Hans-Conrad Description of Ba~1+<i>x~</i>Ni~<i>x~</i>Rh~1{-~<i>x</i>}O~3~ with <i>x</i> = 0.1170(5) in superspace: modulated composite <i>versus</i> modulated-layer structure Acta Crystallographica Section B, 2006, 62, 197-204 |
| 2106028 | CIF | H10 Mg Mo O9 | P -1 | 6.529; 10.706; 6.341 76.44; 109.03; 90.31 | 406.11 | Bars, O.; Grandjean, D.; le Marouille, J.Y. Etude de chromates, molybdates et tungstates hydrates, 1. Etude structurale de Mg Mo O4 (H2 O)5 Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1155-1157 |
| 2106705 | CIF | K O4 Re | I 41/a :2 | 5.66; 5.66; 12.677 90; 90; 90 | 406.115 | Lock, C.J.L.; Turner, G. A reinvestigation of the crystal structure of potassium perrhenate Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1764-1765 |
| 2101933 | CIF Paper | C10 H10 Fe | P 1 21/a 1 | 10.53; 7.604; 5.921 90; 121.05; 90 | 406.2 | Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B, 1997, 53, 928-938 |
| 2101935 | CIF Paper | C10 H10 Fe | P 1 21/a 1 | 10.53; 7.604; 5.921 90; 121.05; 90 | 406.2 | Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B, 1997, 53, 928-938 |
| 2101937 | CIF Paper | C10 H10 Fe | P 1 21/a 1 | 10.53; 7.604; 5.921 90; 121.05; 90 | 406.2 | Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B, 1997, 53, 928-938 |
| 9011204 | CIF | Bi Te | P -3 m 1 | 4.423; 4.423; 24.002 90; 90; 120 | 406.642 | Yamana, K.; Kihara, K.; Matsumoto, T. Bismuth tellurides: BiTe and Bi4Te3 Note: anisoB's from ICSD Acta Crystallographica, Section B, 1979, 35, 147-149 |
| 2104046 | CIF Paper | C3 D4 O4 | P -1 | 10.663; 5.142; 11.234 103.39; 136.81; 85.19 | 406.8 | McMullan, R. K.; Klooster, W. T.; Weber, H.-P. Deuterated γ-malonic acid: its neutron crystal structure in relationship to other polymorphs of aliphatic dicarboxylic acids Acta Crystallographica Section B, 2008, 64, 230-239 |
| 2105377 | CIF | Ag6 O7 Si2 | P 1 2/n 1 | 10.264; 5.259; 8.052 90; 110.5; 90 | 407.109 | Jansen, M. Silber(I)-disilikat Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3584-3586 |
| 2108206 | CIF | C4 H4 O4 | P b c a | 4.9209; 7.1818; 11.5243 90; 90; 90 | 407.28 | Hutchison, Ian B.; Bull, Craig L.; Marshall, William G.; Parsons, Simon; Urquhart, Andrew J.; Oswald, Iain D. H. Compression of glycolide-h~4~ to 6GPa Acta Crystallographica Section B, 2017, 73, 1151-1157 |
| 2104791 | CIF Paper | C H6 Br3 N Sn | P m c 21 | 5.89406; 8.38619; 8.24063 90; 90; 90 | 407.32 | Swainson, Ian; Chi, Lisheng; Her, Jae-Hyuk; Cranswick, Lachlan; Stephens, Peter; Winkler, Björn; Wilson, Daniel J.; Milman, Victor Orientational ordering, tilting and lone-pair activity in the perovskite methylammonium tin bromide, CH~3~NH~3~SnBr~3~ Acta Crystallographica Section B, 2010, 66, 422-429 |
| 2105110 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 5.5267; 8.366; 8.812 90; 90; 90 | 407.4 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2105100 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.7926; 8.7932; 9.907 90; 102.14; 90 | 408.2 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2103569 | CIF HKL Paper | C5 H12 Cl N3 O2 | P 1 21 1 | 7.741; 4.8907; 10.8159 90; 94.18; 90 | 408.39 | In, Yasuko; Fujii, Mayumi; Sasada, Yasuhiro; Ishida, Toshimasa Structural studies on C-amidated amino acids and peptides: structures of hydrochloride salts of C-amidated Ile, Val, Thr, Ser, Met, Trp, Gln and Arg, and comparison with their C-unamidated counterparts Acta Crystallographica Section B, 2001, 57, 72-81 |
| 2105677 | CIF Paper | C2 H2 Cl Li O2 | P 1 21/c 1 | 9.3882; 4.8452; 9.0119 90; 94.33; 90 | 408.76 | Ehrenberg, H.; Hasse, B.; Schwarz, K.; Epple, M. Structure determination of lithium chloroacetate, lithium bromoacetate and lithium iodoacetate by powder diffraction Acta Crystallographica Section B, 1999, 55, 517-524 |
| 2107204 | CIF | Pt3 Ti | P -3 m 1 | 5.491; 5.491; 15.67 90; 90; 120 | 409.169 | Sinha, A.K. The crystal structure of Ti (Pt.89 Ni.11)3 Acta Crystallographica B (24,1968-38,1982), 1969, 25, 996-997 |
| 2100793 | CIF Paper | Al3 La Ni2 | C m c m | 10.173; 7.834; 5.1374 90; 90; 90 | 409.43 | Gladyshevskii, R. E.; Cenzual, K.; Parthé, E. LaNi~2~Al~3~, a ternary substitution variant of the orthorhombic BaZn~5~ type Acta Crystallographica Section B, 1992, 48, 389-392 |
| 2104047 | CIF Paper | C3 D4 O4 | P -1 | 10.675; 5.152; 11.238 103.35; 136.68; 85.07 | 409.45 | McMullan, R. K.; Klooster, W. T.; Weber, H.-P. Deuterated γ-malonic acid: its neutron crystal structure in relationship to other polymorphs of aliphatic dicarboxylic acids Acta Crystallographica Section B, 2008, 64, 230-239 |
| 2103410 | CIF Paper | C6 H6 N2 O4 S | P 1 21 1 | 7.7169; 8.0514; 7.0334 90; 110.274; 90 | 409.924 | Tremayne, Maryjane; Seaton, Colin C.; Glidewell, Christopher Structures of three substituted arenesulfonamides from X-ray powder diffraction data using the differential evolution technique Acta Crystallographica Section B, 2002, 58, 823-834 |
| 2106680 | CIF | K2 O8 V3 | P 4 b m | 8.87; 8.87; 5.215 90; 90; 90 | 410.3 | Galy, J.; Carpy, A. Structure cristalline de K2 V3 O8 ou K2 (V O) (V2 O7) Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1794-1795 |
| 2105109 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 5.514; 8.396; 8.868 90; 90; 90 | 410.5 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2106525 | CIF | Ca O11 Ta4 | P 63 2 2 | 6.2173; 6.2173; 12.271 90; 90; 120 | 410.785 | Isobe, M.; Marumo, F.; Iwai, S.I.; Kimura, M. Calcium tetratantalate Acta Crystallographica B (24,1968-38,1982), 1975, 31, 908-910 |
| 2106687 | CIF | F2 O2 P Rb | P n m a | 8.165; 6.464; 7.786 90; 90; 90 | 410.934 | Granier, W.; Durand, J.; le Cot, L.; Galigne, J.L. Etudes structurales de composes oxyfluores du P(V). IV. Structure de Rb P O2 F2 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2506-2507 |
| 2102919 | CIF HKL Paper | Ge Na O5 Ta | P 1 21/c 1 | 6.838; 8.93; 7.414 90; 114.8; 90 | 410.97 | Malcherek, Thomas A structural phase transition in NaTaOGeO~4~ and its relation to phase transitions in titanite Acta Crystallographica Section B, 2007, 63, 545-550 |
| 2104783 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.7464; 5.834; 12.26 90; 90; 90 | 411 | Tumanov, N. A.; Boldyreva, E. V.; Kolesov, B. A.; Kurnosov, A. V.; Quesada Cabrera, R. Pressure-induced phase transitions in <small>L</small>-alanine, revisited Acta Crystallographica Section B, 2010, 66, 458-471 |
| 1001173 | CIF | O22 P2 Rb0.45 W6 | P 1 2/m 1 | 13.991; 3.765; 8.561 90; 114.22; 90 | 411.3 | Giroult, J P; Goreaud, M; Labbe, P; Raveau, B Bronzes with a Tunnel Structure Rb~x~ P~8~ W~8n~ O~24n+16~. II. The Third Term of the Series: Rb~x~ P~8~ W~24~ O~88~ Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1163-1166 |
| 2106322 | CIF | Cl4 Mn Rb2 | I 4/m m m | 5.05; 5.05; 16.14 90; 90; 90 | 411.61 | Goodyear, J.; Ali, E.M.; Steigmann, G.A. Rubidium tetrachloromanganate Acta Crystallographica B (24,1968-38,1982), 1977, 33, 2932-2933 |
| 2105685 | CIF Paper | Mg2 O6 Si2 | C 1 2/c 1 | 9.5387; 8.6601; 5.262 90; 108.701; 90 | 411.72 | Yoshiasa, Akira; Nakatsuka, Akihiko; Okube, Maki; Katsura, Tomoo Single-crystal metastable high-temperature <i>C</i>2/<i>c</i> clinoenstatite quenched rapidly from high temperature and high pressure Acta Crystallographica Section B, 2013, 69, 541-546 |
| 2100494 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.8065; 5.7061; 9.6871 90; 107.409; 90 | 411.74 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
| 2102934 | CIF Paper | C4 Br4 S | P 1 n 1 | 12.376; 4.004; 8.816 90; 109.452; 90 | 411.9 | Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing Acta Crystallographica Section B, 2007, 63, 783-790 |
| 2102920 | CIF HKL Paper | Ge Na O5 Ta | C 1 2/c 1 | 6.854; 8.933; 7.418 90; 114.858; 90 | 412.1 | Malcherek, Thomas A structural phase transition in NaTaOGeO~4~ and its relation to phase transitions in titanite Acta Crystallographica Section B, 2007, 63, 545-550 |
| 2106821 | CIF | P Pd6 | P 1 21/c 1 | 5.674; 9.4409; 8.21 90; 110.414; 90 | 412.17 | Andersson, Y.; Rundqvist, S.; Tellgren, R.; Thomas, J.O.; Flanagan, T.B. Neutron Powder Diffraction Investigation of Pure and Deuterated Palladium Phosphide Pd6 P Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1965-1972 |
| 2106096 | CIF | Gd0.75 Ni Y0.25 | P 1 21/m 1 | 18.2; 4.212; 5.506 90; 102.37; 90 | 412.282 | Klepp, K.; Parthe, E. Fe B - Cr B stacking variations for rare-earth-nickel alloys in the quasi-binary sections R1-x Rx Ni Acta Crystallographica B (24,1968-38,1982), 1980, 36, 774-782 |
| 2108521 | CIF HKL | Cu6 H16 O21 S2 Zn | P 3 | 8.1905; 8.1905; 7.099 90; 90; 120 | 412.43 | Elliott, Peter Hodgesmithite, (Cu,Zn)~6~Zn(SO~4~)~2~(OH)~10~·3H~2~O, a new copper zinc sulfate mineral with a unique, decorated, interrupted-sheet structure Acta Crystallographica Section B, 2019, 75 |
| 2102945 | CIF Paper | O3 Pb Ti0.35 Zr0.65 | R 3 c :H | 5.7779174; 5.7779174; 14.2692051 90; 90; 120 | 412.547 | Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A. X-ray powder difraction structural characterization of Pb(1-x)Ba(x)Zr(0.65)Ti(0.35)O3 ceramic. Acta Crystallographica, Section B, 2007, 63, 713-718 |
| 2102564 | CIF HKL Paper | C8 H8 O6 | P -1 | 3.6673; 9.7608; 11.8421 97.647; 90.219; 100.537 | 412.87 | Bawa, Shaleen; Coté, Marie L.; Dubois, Patrick; Lalancette, Roger A.; Thompson, Hugh W. 2-Hydroxyisophthalic acid: hydrogen-bonding patterns in the monohydrate and the tetraphenylphosphonium salt. An instance of dramatic acidity enhancement by symmetric, internally hydrogen-bonded anion stabilization Acta Crystallographica Section B, 2004, 60, 438-446 |
| 9011112 | CIF | B2 Ca H12 O10 | P 1 2/c 1 | 8.04; 6.69; 7.95 90; 104.9; 90 | 413.233 | Sedlacek, P.; Dornberger-Schiff K An OD-Disordered modification of the calcium monoborate dihydrate Ca[B(OH)4]2*2H2O Sample: MDO (2) Acta Crystallographica, Section B, 1971, 27, 1532-1541 |
| 2101999 | CIF Paper | Hf0.8 O3 Pb Ti0.2 | R 3 c :H | 5.7827; 5.7827; 14.2702 90; 90; 120 | 413.259 | Christophe Muller; Jean-Louis Baudour; Cédric Bedoya; Françoise Bouree; Jean-Louis Soubeyroux; Marc Roubin Octahedral deformations and cationic displacements in the ferroelectric PbHf~0.8~Ti~0.2~O~3~: a neutron powder diffraction study from 10 to 770K Acta Crystallographica Section B, 2000, 56, 27-38 |
| 2105144 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.938; 5.9485; 5.8266 90; 90; 90 | 413.77 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2102000 | CIF Paper | Hf0.8 O3 Pb Ti0.2 | R 3 c :H | 5.7871; 5.7871; 14.2735 90; 90; 120 | 413.984 | Christophe Muller; Jean-Louis Baudour; Cédric Bedoya; Françoise Bouree; Jean-Louis Soubeyroux; Marc Roubin Octahedral deformations and cationic displacements in the ferroelectric PbHf~0.8~Ti~0.2~O~3~: a neutron powder diffraction study from 10 to 770K Acta Crystallographica Section B, 2000, 56, 27-38 |
| 2102947 | CIF Paper | Ba0.1 O3 Pb0.9 Ti0.35 Zr0.65 | R 3 c :H | 5.78826; 5.78826; 14.27227 90; 90; 120 | 414.114 | Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A. X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic Acta Crystallographica Section B, 2007, 63, 713-718 |
| 2106822 | CIF | D0.0915 P Pd6 | P 1 21/c 1 | 5.6846; 9.4611; 8.2181 90; 110.414; 90 | 414.232 | Andersson, I.; Flanagan, T.B.; Tellgren, R.; Thomas, J.O.; Rundqvist, S. Neutron powder diffraction Investigation of pure and deuterated palladium phosphide Pd6 P Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1965-1972 |
| 2106825 | CIF | D0.09 P Pd6 | P 1 21/c 1 | 5.6847; 9.4621; 8.202 90; 110.109; 90 | 414.285 | Andersson, Y.; Thomas, J.O.; Rundqvist, S.; Flanagan, T.B.; Tellgren, R. Neutron powder diffraction Investigation of pure and deuterated palladium phosphide Pd6 P Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1965-1972 |
| 1007017 | CIF | Be O6 P2 | P 1 21/n 1 | 6.959; 12.853; 4.839 90; 106.79; 90 | 414.4 | Averbuch-Pouchot, M T; Durif, A; Tordjman, I Structure cristalline du polyphosphate de beryllium: Be (P O~3~)~2~ (II) Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3462-3464 |
| 2106823 | CIF | D0.1415 P Pd6 | P 1 21/c 1 | 5.6858; 9.4632; 8.2192 90; 110.431; 90 | 414.421 | Andersson, Y.; Thomas, J.O.; Rundqvist, S.; Tellgren, R.; Flanagan, T.B. Neutron powder diffraction Investigation of pure and deuterated palladium phosphide Pd6 P Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1965-1972 |
| 2105099 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.8098; 8.8377; 9.971 90; 101.94; 90 | 414.7 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2101468 | CIF Paper | C10 H10 V | P 1 21/n 1 | 5.7208; 8.211; 8.831 90; 90.94; 90 | 414.77 | Antipin, M. Yu.; Boese, R. Structure of vanadocene in the temperature interval 108–357 K and the nature of the ring disorder Acta Crystallographica Section B, 1996, 52, 314-322 |
| 2104952 | CIF Paper | Rb2 S | P n m a | 8.167; 5.101; 9.957 90; 90; 90 | 414.8 | Santamaria-Perez, David; Vegas, Angel; Muehle, Claus; Jansen, Martin High-pressure experimental study on Rb~2~S: antifluorite to Ni~2~In-type phase transitions Acta Crystallographica Section B, 2011, 67, 109-115 |
| 2108726 | CIF HKL | B12 Yb | F m -3 m | 7.4584; 7.4584; 7.4584 90; 90; 90 | 414.89 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108727 | CIF HKL | B12 Yb | F m -3 m | 7.4585; 7.4585; 7.4585 90; 90; 90 | 414.911 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2109086 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.82719; 10.1348; 7.20284 90; 102.711; 90 | 414.956 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2106824 | CIF | D0.1755 P Pd6 | P 1 21/c 1 | 5.687; 9.4654; 8.2196 90; 110.3; 90 | 414.977 | Andersson, Y.; Tellgren, R.; Rundqvist, S.; Flanagan, T.B.; Thomas, J.O. Neutron powder diffraction Investigation of pure and deuterated palladium phosphide Pd6 P Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1965-1972 |
| 2102001 | CIF Paper | Hf0.8 O3 Pb Ti0.2 | R 3 c :H | 5.7943; 5.7943; 14.2742 90; 90; 120 | 415.035 | Christophe Muller; Jean-Louis Baudour; Cédric Bedoya; Françoise Bouree; Jean-Louis Soubeyroux; Marc Roubin Octahedral deformations and cationic displacements in the ferroelectric PbHf~0.8~Ti~0.2~O~3~: a neutron powder diffraction study from 10 to 770K Acta Crystallographica Section B, 2000, 56, 27-38 |
| 2108722 | CIF HKL | B12 Yb | F m -3 m | 7.4598; 7.4598; 7.4598 90; 90; 90 | 415.128 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108728 | CIF HKL | B12 Yb | F m -3 m | 7.4599; 7.4599; 7.4599 90; 90; 90 | 415.144 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108723 | CIF HKL | B12 Yb | F m -3 m | 7.46; 7.46; 7.46 90; 90; 90 | 415.161 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108724 | CIF HKL | B12 Yb | F m -3 m | 7.4602; 7.4602; 7.4602 90; 90; 90 | 415.194 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108725 | CIF HKL | B12 Yb | F m -3 m | 7.4603; 7.4603; 7.4603 90; 90; 90 | 415.211 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2106702 | CIF | Cd Cl2 H2 O | P n m a | 9.25; 3.776; 11.89 90; 90; 90 | 415.294 | Leligny, H.; Monier, J.C. Structure cristalline de Cd Cl2 H2 O Acta Crystallographica B (24,1968-38,1982), 1974, 30, 305-309 |
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