Crystallography Open Database
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Searching journal of publication like 'Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1008194 | CIF | Cd Mo3 O16 Y4 | P n -3 n :2 | 10.688; 10.688; 10.688 90; 90; 90 | 1220.9 | Bourdet, J B; Chevalier, R; Fournier, J P; Kohlmuller, R; Omaly, J A structural study of cadmium yttrium molybdate Cd Y~4~ Mo~3~ O~16~ Acta Crystallographica B (24,1968-38,1982), 1982, 38, 2371-2374 |
| 1008280 | CIF | Nb4 O12 U | I m m m | 15.424; 7.712; 15.592 90; 90; 90 | 1854.7 | Labeau, M.; Grey, I. E.; Coubert, J. C.; Chenevas, J.; Collomb, A.; Guitel, J. C. The structure of the a-cation deficient Perovskite U Nb~4~ O~12~ Acta Crystallographica B (39,1983-), 1985, 41, 33-41 |
| 1008281 | CIF | Nb2 O6 U0.5 | P 4/m m m | 3.856; 3.856; 7.796 90; 90; 90 | 115.9 | Labeau, M; Grey, I E; Coubert, J C; Chenevas, J; Collomb, A; Guitel, J C The structure of the a-cation deficient Perovskite U Nb~4~ O~12~ Acta Crystallographica B (24,1968-38,1982), 1985, 41, 33-41 |
| 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 |
| 1008323 | CIF | Rh6 Sn18.4 Tb4.6 | F m -3 m | 13.772; 13.772; 13.772 90; 90; 90 | 2612.1 | Miraglia, S; Hodeau, J L; de Bergevin, F; Marezio, M Structural studies by electron and X-ray diffraction of the disordered phases II: (Sn~1-x~Tb~x~)Tb~4~Rh~6~Sn~18~ and (Sn~1- x~Dy~x~)Dy~4~Os~6~Sn~18~ Acta Crystallographica B (39,1983-), 1987, 43, 76-83 |
| 1008324 | CIF | Rh6 Sn17.6 Tb5 | I 41/a c d :1 | 13.772; 13.772; 27.544 90; 90; 90 | 5224.2 | Miraglia, S; Hodeau, J L; de Bergevin, F; Marezio, M Structural studies by electron and X-ray diffraction of the disordered phases II: (Sn~1-x~Tb~x~)Tb~4~Rh~6~Sn~18~ and (Sn~1- x~Dy~X~)Dy~4~Os~6~Sn~18~ Acta Crystallographica B (39,1983-), 1987, 43, 76-83 |
| 1008498 | CIF | Cu O6 Pt Sr3 | C 1 2/c 1 | 9.317; 9.72; 6.685 90; 91.95; 90 | 605.1 | Hodeau, J L; Tu, H Y; Bordet, P; Fournier, T; Strobel, P; Marezio, M; Chandrashekhar, G V Structure and twinning of Sr~3~CuPtO~6~ Acta Crystallographica B (39,1983-), 1992, 48, 1-11 |
| 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 |
| 1008747 | CIF | As3 Fe H16 O17 | P 1 21/n 1 | 15.25; 19.59999; 4.72 90; 91.8; 90 | 1410.1 | Boudjada, A; Guitel, J C Ytructure cristalline d'un orthoarseniate acide de fer(III) pentahydrate: Fe (H2 As O4)3 (H2 O)5 Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1402-1405 |
| 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 |
| 1008758 | CIF | H20 Na2 O14 S | P 1 21/c 1 | 11.512; 10.37; 12.847 90; 107.789; 90 | 1460.3 | Levy, H. A.; Lisensky, G. C. Crystal structures of sodium sulfate decahydrate (Glauber's salt) and sodium tetraborate decahydrate (borax). Redetermination by neutron diffraction Locality: synthetic Note: anisoU's from ICSD Acta Crystallographica, Section B, 1978, 34, 3502-3510 |
| 1008762 | CIF | Fe H O2 | P -3 m 1 | 2.95; 2.95; 4.56 90; 90; 120 | 34.4 | Patrat, G.; de Bergevin, F.; Pernet, M.; Joubert, J. C. Structure locale de δ-FeOOH Acta Crystallographica, Section B: Structural Science, 1983, 39, 165-170 |
| 1008812 | CIF | B4 H20 Na2 O17 | C 1 2/c 1 | 11.885; 10.654; 12.206 90; 106.623; 90 | 1481 | Levy, H. A.; Lisensky, G. C. Crystal structures of sodium sulfate decahydrate (Glauber's salt) and sodium tetraborate decahydrate (borax). Redetermination by neutron diffraction Note: anisoU's from ICSD Acta Crystallographica, Section B, 1978, 34, 3502-3510 |
| 1008813 | CIF | Ba1.2 Mg1.2 O16 Ti6.8 | I 1 2/m 1 | 10.227; 14.907; 9.964 90; 90.77; 90 | 1518.9 | 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 |
| 1008833 | CIF | H9 Na3 O14 P2 Te | P 63 2 2 | 7.883; 7.883; 10.863 90; 90; 120 | 584.6 | Averbuch-Pouchot, M T Structure d'un phosphate tellurate de sodium: Te (O H)6 Na2 H P O4 Na H2 P O4 Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2405-2406 |
| 1008912 | CIF | O6 V2 W | P 42/m n m | 4.6213; 4.6213; 8.8864 90; 90; 90 | 189.8 | Hodeau, J L; Gondrand, M; Labeau, M; Joubert, J C Structure cristalline de W2 O6 sur monocristal a 298 et 383K Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3543-3547 |
| 1008913 | CIF | O6 V2 W | P 42/m n m | 4.6212; 4.6212; 8.8959 90; 90; 90 | 190 | Hodeau, J L; Gondrand, M; Labeau, M; Joubert, J C Structure cristalline de W~2~ O~6~ sur monocristal a 298 et 383K Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3543-3547 |
| 1008938 | CIF | F6 Pa Rb | C m m a | 8.0483; 12.025; 5.8608 90; 90; 90 | 567.2 | Burns, J H; Levy, H A; Keller, O L The crystal structure of rubidium hexafluoroprotactinate Rb Pa F6 Acta Crystallographica B (24,1968-38,1982), 1968, 24, 1675-1680 |
| 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 |
| 1008956 | CIF | Cr N | F m -3 m | 4.148; 4.148; 4.148 90; 90; 90 | 71.4 | Nasr Eddine, M; Bertaut, E F; Roubin, M; Paris, J Etude cristallographique de Cr(1-x) V(x) N a basse temperature Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3010-3013 |
| 1008957 | CIF | Cr0.5 N V0.5 | F m -3 m | 4.139; 4.139; 4.139 90; 90; 90 | 70.9 | Nasr Eddine, M; Bertaut, E F; Roubin, M; Paris, J Etude cristallographique de Cr(1-x) V(x) N a basse temperature Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3010-3013 |
| 1008958 | CIF | Cr0.9375 N V0.0625 | F m -3 m | 4.1465; 4.1465; 4.1465 90; 90; 90 | 71.3 | Nasr Eddine, M; Bertaut, E F; Roubin, M; Paris, J Etude cristallographique de Cr(1-x) V(x) N a basse temperature Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3010-3013 |
| 1008959 | CIF | Cr0.9375 N V0.0625 | P n m m :2 | 2.8831; 2.9638; 4.1342 90; 90; 90 | 35.3 | Nasr Eddine, M; Bertaut, E F; Roubin, M; Paris, J Etude cristallographique de Cr(1-x) V(x) N a basse temperature Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3010-3013 |
| 1009025 | CIF | Hf0.4 O3 Pb Ti0.6 | P 4 m m | 3.999; 3.999; 4.12 90; 90; 90 | 65.9 | Muller, C; Baudour, J-L; Madigou, V; Bouree, F; Kiat, J-M; Favotto, C; Roubin, M Temperature-dependent neutron powder diffraction evidence for splitting of the cationic sites in the ferroelectric Pb Hf0.4 Ti0.6 O3 Acta Crystallographica B (39,1983-), 1999, 55, 8-16 |
| 1009026 | CIF | Hf0.4 O3 Pb Ti0.6 | P 4 m m | 4.012; 4.012; 4.1 90; 90; 90 | 66 | Muller, C; Baudour, J-L; Madigou, V; Bouree, F; Kiat, J-M; Favotto, C; Roubin, M Temperature-dependent neutron powder diffraction evidence for splitting of the cationic sites in the ferroelectric Pb Hf0.4 Ti0.6 O3 Acta Crystallographica B (39,1983-), 1999, 55, 8-16 |
| 1009027 | CIF | Hf0.4 O3 Pb Ti0.6 | P m -3 m | 4.046; 4.046; 4.046 90; 90; 90 | 66.2 | Muller, C; Baudour, J-L; Madigou, V; Bouree, F; Kiat, J-M; Favotto, C; Roubin, M Temperature-dependent neutron powder diffraction evidence for splitting of the cationic sites in the ferroelectric Pb Hf0.4 Ti0.6 O3 Acta Crystallographica B (39,1983-), 1999, 55, 8-16 |
| 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 |
| 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 |
| 1100051 | CIF | Al65 Cr27 Fe8 | R 3 m :H | 12.6963024; 12.6963024; 7.9210911 90; 90; 120 | 1105.78 | 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 |
| 1100057 | CIF | Cu5 Zn8 | I -4 3 m | 8.878; 8.878; 8.878 90; 90; 90 | 699.75 | Brandon, J. K.; Brizard, R. Y.; Chieh, P. C.; McMillan, R. K.; Pearson, W. B. New refinements of the γ brass type structures Cu~5~Zn~8~, Cu~5~Cd~8~ and Fe~3~Zn~10~ Acta Crystallographica Section B, 1974, 30, 1412-1417 |
| 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 |
| 1100070 | CIF | H12 Mg O9 S2 | P n m a | 9.397; 14.555; 6.864 90; 90; 90 | 938.8 | Baggio, S; Amzel, L; Becka, L N Refinement of the structure of magnesium thiosulfate hexahydrate, Mg S~2~ O~3~ (H~2~ O)~6~ Acta Crystallographica B (24,1968-38,1982), 1969, 25, 1650-2653 |
| 1100073 | CIF | H12 Mg O9 S2 | P n m a | 9.405; 14.449; 6.866 90; 90; 90 | 933 | Elerman, Y; Fuess, H; Joswig, W Hydrogen Bonding in Magnesium Thiosulphate Hexahydrate Mg S~2~ O~3~ (H~2~ O)~6~. A Neutron Diffraction Study Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1799-1801 |
| 1100074 | CIF | H12 Mg O9 S2 | P n m a | 9.304; 14.447; 6.847 90; 90; 90 | 920.3 | Elerman, Y; Fuess, H; Joswig, W Hydrogen Bonding in Magnesium Thiosulphate Hexahydrate Mg S~2~ O~3~ (H~2~ O)~6~. A Neutron Diffraction Study Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1799-1801 |
| 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 |
| 1100077 | CIF | H12 Mg O9 S2 | P n m a | 9.397; 14.455; 6.864 90; 90; 90 | 932.4 | Baggio, S; Amzel, L M; Becka, L N Refinement of the structure of magnesium thiosulphate hexahydrate, Mg S~2~ O~3~ (H~2~ O)~6~ Acta Crystallographica B (24,1968-38,1982), 1969, 25, 2650-2653 |
| 1100081 | CIF | H12 Mg O9 S | R 3 :R | 5.911; 5.911; 5.911 96.25; 96.25; 96.25 | 202.6 | Bats, J W; Fuess, H; Elerman, Y Deformation density in magnesium sulfite hexahydrate. Acta Crystallographica B (39,1983-), 1986, 42, 552-557 |
| 1100082 | CIF | H12 Mg O9 S | R 3 :R | 5.911; 5.911; 5.911 96.25; 96.25; 96.25 | 202.6 | Bats, J. W.; Fuess, H.; Elerman, Y. Deformation density in magnesium sulfite hexahydrate Acta Crystallographica B (39,1983-), 1986, 42, 552-557 |
| 1100083 | CIF | H12 Mg O9 S | R 3 :R | 5.911; 5.911; 5.911 96.25; 96.25; 96.25 | 202.6 | Bats, J. W.; Fuess, H.; Elerman, Y. Deformation density in magnesium sulfite hexahydrate Acta Crystallographica B (39,1983-), 1986, 42, 552-557 |
| 1100095 | CIF | H14 Mg6 O16 S | C c m m | 15.895; 3.105; 13.367 90; 90; 90 | 659.7 | Hamada, E.; Ishizawa, N.; Marumo, F.; Ohsumi, K.; Shimizugawa, Y.; Reizen, K.; Matsunami, T. Structure of Mg~6~SO~2~(OH)~14~ determined by micro single-crystal X-ray diffraction Acta Crystallographica B (39,1983-), 1996, 52, 266-269 |
| 1100099 | CIF | H2 Mg3 O10 S2 | P 43 21 2 | 7.454; 7.454; 12.885 90; 90; 90 | 715.9 | Fleet, M. E.; Knipe, S. W. Structure of magnesium hydroxide sulfate (2(Mg S O4) . (Mg (O H)2)) and solid solution in magnesium hydroxide sulfate hydrate and caminite Acta Crystallographica B (39,1983-), 1997, 53, 358-363 |
| 1100101 | CIF | H14 Mg O11 S | P 21 21 21 | 11.887; 12.013; 6.861 90; 90; 90 | 979.7 | Calleri, M.; Gavetti, A.; Ivaldi, G.; Rubbo, M. Synthetic epsomite, MgSO~4~ . 7H~2~O: absolute configuration and surface features of the complementary {111} forms Acta Crystallographica Section B, 1984, 40, 218-222 |
| 1100103 | CIF | H12 Mg O9 S | R 3 :H | 8.83; 8.83; 9.075 90; 90; 120 | 612.8 | Flack, H Etude de la structure cristalline du sulfite de magnesium hexahydrate, Mg S O3 (H2 O)6 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 656-658 |
| 1101062 | CIF Paper | Ca2 Fe2 O5 | Imma(00\g)s00 | 5.4931; 15.038; 5.6511 90; 90; 90 | 466.81 | Krüger, Hannes; Kahlenberg, Volker Incommensurately modulated ordering of tetrahedral chains in Ca~2~Fe~2~O~5~ at elevated temperatures Acta Crystallographica Section B, 2005, 61, 656-662 |
| 1200007 | CIF | Al0.72 Ca2 Fe1.28 O5 | I b m 2 | 5.583; 14.58; 5.374 90; 90; 90 | 437.4 | Colville, A A; Geller, S Crystal structures of Ca~2~ Fe~1.43~ Al~0.57~ O~5~ and Ca~2~ Fe~1.28~ Al~0.72~ O~5~ Acta Crystallographica B (24,1968-38,1982), 1972, 28, 3196-3200 |
| 1200009 | CIF | Al Ca2 Fe O5 | I b m 2 | 5.584; 14.6; 5.374 90; 90; 90 | 438.1 | Colville, A A; Geller, S The Crystal Structure of Brownmillerite, Ca2 Fe Al O5 Acta Crystallographica B (24,1968-38,1982), 1971, 27, 2311-2315 |
| 1200013 | CIF | K N O3 | R -3 m :H | 5.425; 5.425; 9.836 90; 90; 120 | 250.7 | Nimmo, J. K.; Lucas, B. W. The crystal structures of γ- and β-KNO~3~ and the α ←γ ←β phase transformations Acta Crystallographica B (24,1968-38,1982), 1976, 32, 1968-1971 |
| 2002890 | CIF Paper | C24 H66 Mo12 N4 O50 P2 | P 1 21/n 1 | 11.211; 12.862; 23.05 90; 94.37; 90 | 3314 | Lyxell,D-G.; Bostrom,D.; Hashimoto,M.; Pettersson,L. Multicomponent Polyanions. 53. Structure of Tetrakis(trimethylammonium) Tetra-μ-oxo-bis(triaquahexadecaoxo(trioxophenylphosphato)hexamolybdate) Dihydrate, [NH(CH~3~)~3~]~4~[{(C~6~H~5~P)Mo~6~O~21~(H~2~O)~3~}~2~].2H~2~O Acta Crystallographica Section B, 1998, 54, 424-430 |
| 2002891 | CIF Paper | Al4.5 Fe Si | A 1 2/a 1 | 6.1676; 6.1661; 20.8093 90; 91; 90 | 791.26 | Hansen, Vidar; Hauback, Bjørn; Sundberg, M.; Rømming, Chr.; Gjønnes, Jon β-Al~4.5~FeSi: A Combined Synchrotron Powder Diffraction, Electron Diffraction, High-Resolution Electron Microscopy and Single-Crystal X-ray Diffraction Study of a Faulted Structure Acta Crystallographica Section B, 1998, 54, 351-357 |
| 2002892 | CIF Paper | Al1.95 Na1.95 O4 Si0.05 | P 41 21 2 | 5.2997; 5.2997; 7.0758 90; 90; 90 | 198.74 | Thompson, John G; Withers, Ray L.; Melnitchenko, Alexandra; Palethorpe, Stephen R. Cristobalite-Related Phases in the NaAlO~2~‒NaAlSiO~4~ System. I. Two Tetragonal and Two Orthorhombic Structures Acta Crystallographica Section B, 1998, 54, 531-546 |
| 2002893 | CIF Paper | Al1.75 Na1.75 O4 Si0.25 | P b c a | 10.416; 14.25; 5.2038 90; 90; 90 | 772.4 | Thompson, John G; Withers, Ray L.; Melnitchenko, Alexandra; Palethorpe, Stephen R. Cristobalite-Related Phases in the NaAlO~2~‒NaAlSiO~4~ System. I. Two Tetragonal and Two Orthorhombic Structures Acta Crystallographica Section B, 1998, 54, 531-546 |
| 2002894 | CIF Paper | Al1.65 Na1.65 O4 Si0.35 | P 41 21 2 | 10.3872; 10.3872; 7.1589 90; 90; 90 | 772.4 | Thompson, John G; Withers, Ray L.; Melnitchenko, Alexandra; Palethorpe, Stephen R. Cristobalite-Related Phases in the NaAlO~2~‒NaAlSiO~4~ System. I. Two Tetragonal and Two Orthorhombic Structures Acta Crystallographica Section B, 1998, 54, 531-546 |
| 2002895 | CIF Paper | Al1.55 Na1.55 O4 Si0.45 | P b c a | 10.385; 14.198; 5.1925 90; 90; 90 | 765.6 | Thompson, John G; Withers, Ray L.; Melnitchenko, Alexandra; Palethorpe, Stephen R. Cristobalite-Related Phases in the NaAlO~2~‒NaAlSiO~4~ System. I. Two Tetragonal and Two Orthorhombic Structures Acta Crystallographica Section B, 1998, 54, 531-546 |
| 2002896 | CIF Paper | Al1.15 Na1.15 O4 Si0.85 | P b 21 a | 10.214; 14.226; 10.308 90; 90; 90 | 1497.8 | Thompson, John G; Withers, Ray L.; Melnitchenko, Alexandra; Palethorpe, Stephen R. Cristobalite-Related Phases in the NaAlO~2~‒NaAlSiO~4~ System. I. Two Tetragonal and Two Orthorhombic Structures Acta Crystallographica Section B, 1998, 54, 531-546 |
| 2002897 | CIF | Al1.45 Na1.45 O4 Si0.55 | P 21 3 | 14.553; 14.553; 14.553 90; 90; 90 | 3082 | Withers, Ray L.; Thompson, John G.; Melnitchenko, Alexandra; Palethorpe, Stephen R. Cristobalite-related phases in the NaAlO2-NaAlSiO4 system II. A commensurately modulated cubic structure Acta Crystallographica, Section B, 1998, 54, 547-557 |
| 2002899 | CIF Paper | C4 H6 N4 Na2 Ni O3 | P -1 | 7.392; 8.895; 15.115 89.12; 87.46; 84.54 | 988.3 | Ptasiewicz-Bąk, H.; Olovsson, I.; McIntyre, G.J. Structure, Charge and Spin Density in Na~2~Ni(CN)~4~.3H~2~O at 295 and 30 K Acta Crystallographica Section B, 1998, 54, 600-612 |
| 2002900 | CIF Paper | C4 H6 N4 Na2 Ni O3 | P -1 | 7.32; 8.902; 15.204 89.333; 87.336; 83.621 | 983.5 | Ptasiewicz-Bąk, H.; Olovsson, I.; McIntyre, G.J. Structure, Charge and Spin Density in Na~2~Ni(CN)~4~.3H~2~O at 295 and 30 K Acta Crystallographica Section B, 1998, 54, 600-612 |
| 2002906 | CIF Paper | C6 H17 I3 N2 O11 | P 1 21 1 | 8.36; 6.33; 14.75 90; 92.86; 90 | 779.6 | A. M. Petrosyan; R. P. Sukiasyan; S. S. Terzyan; V. M. Burbelo Interaction of lysine with iodic acid Acta Crystallographica Section B, 1999, 55, 221-225 |
| 2002907 | CIF Paper | As2 Cs0.14 O10 Rb1.86 Ti2 | P n a 21 | 13.2691; 6.6848; 10.7629 90; 90; 90 | 954.68 | Womersley, M. N.; Thomas, P. A.; Corker, D. L. Investigation of the Cs~<i>x~</i>Rb~1{-~<i>x</i>}TiOAsO~4~ Series. I. Crystal Structure Analysis and Pseudo-symmetry Acta Crystallographica Section B, 1998, 54, 635-644 |
| 2002908 | CIF Paper | As2 Cs0.62 O10 Rb1.38 Ti2 | P n a 21 | 13.33; 6.7181; 10.762 90; 90; 90 | 963.8 | Womersley, M. N.; Thomas, P. A.; Corker, D. L. Investigation of the Cs~<i>x~</i>Rb~1{-~<i>x</i>}TiOAsO~4~ Series. I. Crystal Structure Analysis and Pseudo-symmetry Acta Crystallographica Section B, 1998, 54, 635-644 |
| 2002909 | CIF Paper | As2 Cs1.15 O10 Rb0.85 Ti2 | P n a 21 | 13.392; 6.769; 10.7524 90; 90; 90 | 974.7 | Womersley, M. N.; Thomas, P. A.; Corker, D. L. Investigation of the Cs~<i>x~</i>Rb~1{-~<i>x</i>}TiOAsO~4~ Series. I. Crystal Structure Analysis and Pseudo-symmetry Acta Crystallographica Section B, 1998, 54, 635-644 |
| 2002910 | CIF Paper | As2 Cs1.43 O10 Rb0.57 Ti2 | P n a 21 | 13.426; 6.8054; 10.7205 90; 90; 90 | 979.52 | Womersley, M. N.; Thomas, P. A.; Corker, D. L. Investigation of the Cs~<i>x~</i>Rb~1{-~<i>x</i>}TiOAsO~4~ Series. I. Crystal Structure Analysis and Pseudo-symmetry Acta Crystallographica Section B, 1998, 54, 635-644 |
| 2002911 | CIF Paper | As2 Cs1.73 O10 Rb0.27 Ti2 | P n a 21 | 13.467; 6.836; 10.704 90; 90; 90 | 985.4 | Womersley, M. N.; Thomas, P. A.; Corker, D. L. Investigation of the Cs~<i>x~</i>Rb~1{-~<i>x</i>}TiOAsO~4~ Series. I. Crystal Structure Analysis and Pseudo-symmetry Acta Crystallographica Section B, 1998, 54, 635-644 |
| 2002912 | CIF Paper | As2 Cs1.4 O10 Rb0.6 Ti2 | P n a 21 | 13.43; 6.8; 10.762 90; 90; 90 | 982.8 | Womersley, M. N.; Thomas, P. A.; Corker, D. L. Investigation of the Cs~<i>x~</i>Rb~1{-~<i>x</i>}TiOAsO~4~ Series. I. Crystal Structure Analysis and Pseudo-symmetry Acta Crystallographica Section B, 1998, 54, 635-644 |
| 2002913 | CIF Paper | As2 Cs1.72 O10 Rb0.28 Ti2 | P n a 21 | 13.442; 6.816; 10.735 90; 90; 90 | 983.5 | Womersley, M. N.; Thomas, P. A.; Corker, D. L. Investigation of the Cs~<i>x~</i>Rb~1{-~<i>x</i>}TiOAsO~4~ Series. I. Crystal Structure Analysis and Pseudo-symmetry Acta Crystallographica Section B, 1998, 54, 635-644 |
| 2002914 | CIF Paper | As2 Cs1.8 O10 Rb0.16 Ti2 | P n a 21 | 13.466; 6.837; 10.704 90; 90; 90 | 985.5 | Thomas, P. A.; Womersley, M. N. Investigation of the Cs~<i>x~</i>Rb~1{-~<i>x</i>}TiOAsO~4~ Series. II. The Problems of Interpretation of Residual Electron Densities in a Polar Space Group Acta Crystallographica Section B, 1998, 54, 645-651 |
| 2002915 | CIF HKL Paper | C13 H19 N O5 | P 21 21 21 | 7.235; 13.056; 14.415 90; 90; 90 | 1361.6 | Slimane Dahaoui; Christian Jelsch; Judith A. K. Howard; Claude Lecomte Charge density study of <i>N</i>-acetyl-<small>L</small>-tyrosine ethyl ester monohydrate derived from CCD area detector data Acta Crystallographica Section B, 1999, 55, 226-230 |
| 2002916 | CIF HKL Paper | C13 H19 N O5 | P 21 21 21 | 7.3827; 13.1421; 14.515 90; 90; 90 | 1408.31 | Slimane Dahaoui; Christian Jelsch; Judith A. K. Howard; Claude Lecomte Charge density study of <i>N</i>-acetyl-<small>L</small>-tyrosine ethyl ester monohydrate derived from CCD area detector data Acta Crystallographica Section B, 1999, 55, 226-230 |
| 2002917 | CIF Paper | C7 H11 N5 O2 | P 1 21/n 1 | 7.4889; 17.273; 7.4073 90; 111.937; 90 | 888.8 | Chernyshev, Vladimir V.; Fitch, Andrew N.; Sonneveld, Eduard J.; Kurbakov, Alexander I.; Makarov, Vadim A.; Tafeenko, Victor A. Crystal and molecular structures of 2-[1-(2-aminoethyl)-2-imidazolidinylidene]-2-nitroacetonitrile (C~7~H~11~N~5~O~2~) and 2,6-diamino-5-hydroxy-3-nitro-4<i>H</i>-pyrazolo[1,5-<i>a</i>]pyrimidin-7-one monohydrate (C~6~H~6~N~6~O~4~·H~2~O) from X-ray, synchrotron and neutron powder diffraction data Acta Crystallographica Section B, 1999, 55, 554-562 |
| 2002918 | CIF Paper | C6 H8 N6 O5 | P 1 21/n 1 | 17.576; 10.9; 4.6738 90; 92.867; 90 | 894.3 | Chernyshev, Vladimir V.; Fitch, Andrew N.; Sonneveld, Eduard J.; Kurbakov, Alexander I.; Makarov, Vadim A.; Tafeenko, Victor A. Crystal and molecular structures of 2-[1-(2-aminoethyl)-2-imidazolidinylidene]-2-nitroacetonitrile (C~7~H~11~N~5~O~2~) and 2,6-diamino-5-hydroxy-3-nitro-4<i>H</i>-pyrazolo[1,5-<i>a</i>]pyrimidin-7-one monohydrate (C~6~H~6~N~6~O~4~·H~2~O) from X-ray, synchrotron and neutron powder diffraction data Acta Crystallographica Section B, 1999, 55, 554-562 |
| 2002919 | CIF Paper | C18 H20 N2 O2 | P 1 21/c 1 | 18.281; 5.379; 8.155 90; 91.25; 90 | 801.72 | Loehlin, J. H.; Franz, K. J.; Gist, L.; Moore, R. H. Supramolecular Alcohol–Amine Crystals and Their Hydrogen-Bond Patterns Acta Crystallographica Section B, 1998, 54, 695-704 |
| 2002920 | CIF Paper | C30 H28 N2 O2 | P 1 21/c 1 | 26.629; 5.426; 8.095 90; 95.15; 90 | 1164.9 | Loehlin, J. H.; Franz, K. J.; Gist, L.; Moore, R. H. Supramolecular Alcohol–Amine Crystals and Their Hydrogen-Bond Patterns Acta Crystallographica Section B, 1998, 54, 695-704 |
| 2002921 | CIF Paper | C16 H16 N2 O2 | P 1 21/c 1 | 14.94; 5.4816; 8.372 90; 90.25; 90 | 685.62 | Loehlin, J. H.; Franz, K. J.; Gist, L.; Moore, R. H. Supramolecular Alcohol–Amine Crystals and Their Hydrogen-Bond Patterns Acta Crystallographica Section B, 1998, 54, 695-704 |
| 2002922 | CIF Paper | C12 H22 N2 O2 | C 1 2/c 1 | 31.2595; 5.1534; 8.2639 90; 104.189; 90 | 1290.64 | Loehlin, J. H.; Franz, K. J.; Gist, L.; Moore, R. H. Supramolecular Alcohol–Amine Crystals and Their Hydrogen-Bond Patterns Acta Crystallographica Section B, 1998, 54, 695-704 |
| 2002923 | CIF Paper | C18 H18 Cl2 N2 O2 | P -1 | 4.4878; 8.785; 11.987 70; 86.67; 82.18 | 439.93 | Loehlin, J. H.; Franz, K. J.; Gist, L.; Moore, R. H. Supramolecular Alcohol–Amine Crystals and Their Hydrogen-Bond Patterns Acta Crystallographica Section B, 1998, 54, 695-704 |
| 2002924 | CIF Paper | C5 H5 N O | P 21 21 21 | 13.585; 5.806; 5.603 90; 90; 90 | 441.9 | Yang, H.W.; Craven, B.M. Charge Density Study of 2-Pyridone Acta Crystallographica Section B, 1998, 54, 912-920 |
| 2002925 | CIF HKL Paper | Be F4 H8 N2 | P n m a | 7.531; 5.874; 10.399 90; 90; 90 | 460 | Srivastava, R. C.; Klooster, W. T.; Koetzle, T. F. Neutron structures of ammonium tetrafluoroberyllate Acta Crystallographica Section B, 1999, 55, 17-23 |
| 2002926 | CIF HKL Paper | Be F4 H8 N2 | P n a 21 | 15.017; 5.876; 10.418 90; 90; 90 | 919.3 | Srivastava, R. C.; Klooster, W. T.; Koetzle, T. F. Neutron structures of ammonium tetrafluoroberyllate Acta Crystallographica Section B, 1999, 55, 17-23 |
| 2002927 | CIF HKL Paper | Be F4 H8 N2 | P n a 21 | 14.997; 5.86; 10.402 90; 90; 90 | 914.2 | Srivastava, R. C.; Klooster, W. T.; Koetzle, T. F. Neutron structures of ammonium tetrafluoroberyllate Acta Crystallographica Section B, 1999, 55, 17-23 |
| 2002928 | CIF Paper | C12 H12 | P b c a | 7.4544; 6.0826; 20.0946 90; 90; 90 | 911.13 | Kaduk, J.A.; Golab, J.T. Structures of 2,6-disubstituted naphthalenes Acta Crystallographica Section B, 1999, 55, 85-94 |
| 2002929 | CIF Paper | C12 H8 O4 | P -1 | 3.7061; 7.4688; 8.535 86.62; 85.49; 87.99 | 235 | Kaduk, J.A.; Golab, J.T. Structures of 2,6-disubstituted naphthalenes Acta Crystallographica Section B, 1999, 55, 85-94 |
| 2002930 | CIF Paper | C14 H12 O4 | P 1 21/c 1 | 13.41931; 6.14869; 7.15257 90; 100.4; 90 | 580.471 | Kaduk, J.A.; Golab, J.T. Structures of 2,6-disubstituted naphthalenes Acta Crystallographica Section B, 1999, 55, 85-94 |
| 2002931 | CIF Paper | Al177 Cr49 Ni | P 63/m | 17.674; 17.674; 12.516 90; 90; 120 | 3385.8 | Marsh, R. E. Concerning the κ Phase of Al‒Cr‒Ni Acta Crystallographica Section B, 1998, 54, 925-926 |
| 2002932 | CIF HKL Paper | C6 H2 Cl2 N2 O2 | C 1 2/c 1 | 11.397; 8.871; 7.222 90; 95.12; 90 | 727.3 | Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z. Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide Acta Crystallographica Section B, 1999, 55, 530-542 |
| 2002933 | CIF HKL Paper | C6 H2 Cl2 N2 O2 | C 1 2/c 1 | 11.554; 8.926; 7.31 90; 96.1; 90 | 749.6 | Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z. Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide Acta Crystallographica Section B, 1999, 55, 530-542 |
| 2002934 | CIF HKL Paper | C6 H2 Cl2 N2 O2 | P 1 21/n 1 | 7.0679; 11.7502; 9.0114 90; 98.563; 90 | 740.05 | Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z. Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide Acta Crystallographica Section B, 1999, 55, 530-542 |
| 2002935 | CIF HKL Paper | C6 H2 Cl2 N2 O2 | P 1 21/n 1 | 7.1739; 11.8351; 9.0639 90; 98.35; 90 | 761.4 | Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z. Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide Acta Crystallographica Section B, 1999, 55, 530-542 |
| 2002936 | CIF HKL Paper | C6 H2 Cl2 N2 O2 | C 1 2/c 1 | 7.2233; 9.0549; 11.57 90; 95.315; 90 | 753.5 | Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z. Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide Acta Crystallographica Section B, 1999, 55, 530-542 |
| 2002937 | CIF HKL Paper | C6 H2 Cl2 N2 O2 | C 1 2/c 1 | 7.293; 9.061; 11.618 90; 96.12; 90 | 763.4 | Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z. Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide Acta Crystallographica Section B, 1999, 55, 530-542 |
| 2002938 | CIF HKL Paper | C8 H2 Cl2 O3 | C 1 2/c 1 | 11.987; 8.994; 7.423 90; 92.91; 90 | 799.2 | Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z. Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide Acta Crystallographica Section B, 1999, 55, 530-542 |
| 2002939 | CIF Paper | C8 H2 Br2 O3 | C -1 | 12.923; 9.209; 7.628 105.08; 99.2; 81.29 | 859.5 | Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z. Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide Acta Crystallographica Section B, 1999, 55, 530-542 |
| 2002940 | CIF Paper | C12 H7 K O3 S | P b c a | 10.76; 7.74; 27.145 90; 90; 90 | 2260.7 | Craven, B. M.; Ballas, F. L. Thermal vibrations in potassium 3-benzoyl-2-thiophenecarboxylate Acta Crystallographica Section B, 1999, 55, 375-379 |
| 2002942 | CIF Paper | Na Nb O3 | C m c m | 7.85758; 7.86793; 7.8765 90; 90; 90 | 486.948 | Darlington, C. N. W.; Knight, K. S. High-temperature phases of NaNbO~3~ and NaTaO~3~ Acta Crystallographica Section B, 1999, 55, 24-30 |
| 2002943 | CIF Paper | Na O3 Ta | C m c m | 7.83729; 7.84887; 7.85728 90; 90; 90 | 483.332 | Darlington, C. N. W.; Knight, K. S. High-temperature phases of NaNbO~3~ and NaTaO~3~ Acta Crystallographica Section B, 1999, 55, 24-30 |
| 2002944 | CIF Paper | Na Nb O3 | P 4/m b m | 5.56896; 5.56896; 3.94408 90; 90; 90 | 122.319 | Darlington, C. N. W.; Knight, K. S. High-temperature phases of NaNbO~3~ and NaTaO~3~ Acta Crystallographica Section B, 1999, 55, 24-30 |
| 2002945 | CIF Paper | Na O3 Ta | P 4/m b m | 5.55465; 5.55465; 3.93426 90; 90; 90 | 121.388 | Darlington, C. N. W.; Knight, K. S. High-temperature phases of NaNbO~3~ and NaTaO~3~ Acta Crystallographica Section B, 1999, 55, 24-30 |
| 2002946 | CIF Paper | C5 H8 N2 | P -1 | 14.417; 12.02; 12.042 119.99; 105.991; 87.224 | 1727.4 | Infantes, L.; Foces-Foces, C.; Elguero,J. 3(5),4-Dimethyl- and 3,4,5-trimethylpyrazole at 200K. X-ray crystallography and quantum-chemical analysis Acta Crystallographica Section B, 1999, 55, 441-447 |
| 2002947 | CIF HKL Paper | C6 H10 N2 | I 1 2/a 1 | 14.1911; 8.252; 16.7382 90; 90.696; 90 | 1960 | Infantes, L.; Foces-Foces, C.; Elguero,J. 3(5),4-Dimethyl- and 3,4,5-trimethylpyrazole at 200K. X-ray crystallography and quantum-chemical analysis Acta Crystallographica Section B, 1999, 55, 441-447 |
| 2002948 | CIF | O8 W2 Zr | P 21 3 | 9.179989; 9.179989; 9.179989 90; 90; 90 | 773.6 | Evans, J. S. O.; David, W. I. F.; Sleight, A. W. Structural investigation of the negative-thermal-expansion material ZrW~2~O~8~ Acta Crystallographica, Section B, 1999, 55, 333-340 |
| 2002949 | CIF Paper | Co0.2 H2 Na O5 P Zn0.8 | P 65 2 2 | 10.464; 10.464; 15.056 90; 90; 120 | 1427.7 | Madeleine Helliwell Determination of the site of incorporation of cobalt in CoZnPO-CZP by multiple-wavelength anomalous-dispersion crystallography Acta Crystallographica Section B, 1999, 55, 327-332 |
| 2002950 | CIF | Nb5 O17 Sr5 | P n n m | 32.456; 5.674; 3.995 90; 90; 90 | 735.7 | Abrahams, Sidney C.; Schmalle, Helmut W.; Williams, Tim; Reller, Armin; Lichtenberg, Frank; Widmer, Daniel; Bednorz, J. Georg; Spreiter, Rolf; Bosshard, Christian; Günter, Peter Centrosymmetric or Noncentrosymmetric? Case Study and Structural Redetermination of Sr~5~Nb~5~O~17~ Acta Crystallographica, Section B, 1998, 54, 399-416 |
| 2002951 | CIF | Nb5 O17 Sr5 | P n n m | 32.456; 5.674; 3.995 90; 90; 90 | 735.7 | Abrahams, Sidney C.; Schmalle, Helmut W.; Williams, Tim; Reller, Armin; Lichtenberg, Frank; Widmer, Daniel; Bednorz, J. Georg; Spreiter, Rolf; Bosshard, Christian; Günter, Peter Centrosymmetric or Noncentrosymmetric? Case Study and Structural Redetermination of Sr~5~Nb~5~O~17~ Acta Crystallographica, Section B, 1998, 54, 399-416 |
| 2002952 | CIF Paper | C H10 F6 N4 O Zr | P 1 21/n 1 | 12.377; 9.7522; 13.8543 90; 97.326; 90 | 1658.6 | Ross II, C. R.; Paulsen, B. L.; Nielson, R. M.; Abrahams, S. C. Aminoguanidinium(2+) Hexafluorozirconate Monohydrate: A Co-Product of Preparing the Ferroelectric Anhydrous Salt Acta Crystallographica Section B, 1998, 54, 417-423 |
| 2002953 | CIF Paper | Co1.26 Fe2.74 La0.743 Sb12 | I m -3 | 9.0971; 9.0971; 9.0971 90; 90; 90 | 752.85 | Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior Acta Crystallographica Section B, 1999, 55, 341-347 |
| 2002954 | CIF Paper | Co1.26 Fe2.74 La0.743 Sb12 | I m -3 | 9.0854; 9.0854; 9.0854 90; 90; 90 | 749.95 | Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior Acta Crystallographica Section B, 1999, 55, 341-347 |
| 2002955 | CIF Paper | Co1.26 Fe2.74 La0.743 Sb12 | I m -3 | 9.0857; 9.0857; 9.0857 90; 90; 90 | 750.02 | Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior Acta Crystallographica Section B, 1999, 55, 341-347 |
| 2002956 | CIF Paper | Co1.26 Fe2.74 La0.743 Sb12 | I m -3 | 9.0813; 9.0813; 9.0813 90; 90; 90 | 748.93 | Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior Acta Crystallographica Section B, 1999, 55, 341-347 |
| 2002957 | CIF Paper | Co1.26 Fe2.74 La0.743 Sb12 | I m -3 | 9.0809; 9.0809; 9.0809 90; 90; 90 | 748.84 | Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior Acta Crystallographica Section B, 1999, 55, 341-347 |
| 2002958 | CIF Paper | Co1.26 Fe2.74 La0.743 Sb12 | I m -3 | 9.0814; 9.0814; 9.0814 90; 90; 90 | 748.96 | Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior Acta Crystallographica Section B, 1999, 55, 341-347 |
| 2002959 | CIF Paper | Co1.26 Fe2.74 La0.743 Sb12 | I m -3 | 9.0839; 9.0839; 9.0839 90; 90; 90 | 749.58 | Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior Acta Crystallographica Section B, 1999, 55, 341-347 |
| 2002960 | CIF Paper | Co1.26 Fe2.74 La0.743 Sb12 | I m -3 | 9.0771; 9.0771; 9.0771 90; 90; 90 | 747.9 | Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior Acta Crystallographica Section B, 1999, 55, 341-347 |
| 2002961 | CIF Paper | Co1.26 Fe2.74 La0.743 Sb12 | I m -3 | 9.0762; 9.0762; 9.0762 90; 90; 90 | 747.67 | Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior Acta Crystallographica Section B, 1999, 55, 341-347 |
| 2002962 | CIF Paper | C H8 F6 N4 Si | P c c n | 10.4232; 17.6675; 7.5363 90; 90; 90 | 1387.82 | 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 |
| 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 |
| 2002964 | CIF | Cs3 H3.5 O12 P0.5 S2.5 | C 1 2/c 1 | 19.769; 7.685; 8.858 90; 100.6; 90 | 1322.8 | Haile, S. M.; Klooster, W. T. Single-crystal neutron diffraction study of β-Cs~3~(HSO~4~)~2~[H~2-x~(S~x~P~1-x~)O~4~] (x ≃ 0.5) at 15 K Acta Crystallographica, Section B: Structural Science, 1999, 55, 285-296 |
| 2002965 | CIF | Cs3 H3.5 O12 P0.5 S2.5 | C 1 2/c 1 | 19.769; 7.685; 8.858 90; 100.6; 90 | 1322.8 | Haile, S. M.; Klooster, W. T. Single-crystal neutron diffraction study of β-Cs~3~(HSO~4~)~2~[H~2-x~(S~x~P~1-x~)O~4~] (x ≃ 0.5) at 15 K Acta Crystallographica, Section B: Structural Science, 1999, 55, 285-296 |
| 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 |
| 2002967 | CIF Paper | C3 H4 F3 N O | P 1 21/n 1 | 4.807; 16.707; 6.708 90; 109.9; 90 | 506.55 | 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 |
| 2002968 | CIF Paper | C3 H2 F3 N | P 21 21 21 | 5.668; 9.266; 8.626 90; 90; 90 | 453 | 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 |
| 2002971 | CIF HKL Paper | C28 H24 N2 O8 S2 | P 1 21/a 1 | 8.3506; 18.0102; 9.636 90; 110.869; 90 | 1354.1 | Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S. Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1) Acta Crystallographica, Section B: Structural Science, 1999, 55, 573-590 |
| 2002972 | CIF HKL Paper | C22 H18 N2 O4 S | P 1 21/n 1 | 7.5765; 23.9154; 11.225 90; 105.921; 90 | 1955.9 | Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S. Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1) Acta Crystallographica, Section B: Structural Science, 1999, 55, 573-590 |
| 2002973 | CIF HKL Paper | C24 H20 N2 O4 S | P -1 | 7.3981; 12.7472; 13.0006 115.037; 102.398; 94.239 | 1065.9 | Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S. Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1) Acta Crystallographica, Section B: Structural Science, 1999, 55, 573-590 |
| 2002974 | CIF HKL Paper | C24 H22 N2 O4 S | P -1 | 7.7599; 12.4866; 12.914 114.003; 104.694; 93.69 | 1085.6 | Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S. Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1) Acta Crystallographica, Section B: Structural Science, 1999, 55, 573-590 |
| 2002975 | CIF HKL Paper | C25 H24 N2 O4 S | P 1 21/c 1 | 10.0292; 15.579; 15.0208 90; 105.47; 90 | 2261.9 | Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S. Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1) Acta Crystallographica, Section B: Structural Science, 1999, 55, 573-590 |
| 2002976 | CIF Paper | C25 H37 N2 O4.5 S | P 21 21 21 | 12.2739; 19.454; 20.6251 90; 90; 90 | 4924.8 | Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S. Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1) Acta Crystallographica, Section B: Structural Science, 1999, 55, 573-590 |
| 2002977 | CIF HKL Paper | C24 H18 N2 O2 | C 1 2/c 1 | 13.0288; 12.1865; 12.0778 90; 105.199; 90 | 1850.6 | Ferguson, George; Glidewell, Christopher; Lavender, Emma S. Crystal engineering using bisphenols and trisphenols. Complexes with 1,10-phenanthroline: hydrogen-bonded chains in adducts with 4,4'-biphenol (1/1) and 4,4'-sulfonyldiphenol (2/3), π–π stacked chains in the (1/2) adduct with 4,4'-thiodiphenol, and pairwise-interwoven nets in 1,1,1-tris(4-hydroxyphenyl)ethane–1,10-phenanthroline–methanol (1/1/1) Acta Crystallographica Section B, 1999, 55, 591-600 |
| 2002978 | CIF HKL Paper | C36 H26 N4 O2 S | P -1 | 7.7342; 13.3624; 14.9843 110.514; 95.195; 95.895 | 1429.3 | Ferguson, George; Glidewell, Christopher; Lavender, Emma S. Crystal engineering using bisphenols and trisphenols. Complexes with 1,10-phenanthroline: hydrogen-bonded chains in adducts with 4,4'-biphenol (1/1) and 4,4'-sulfonyldiphenol (2/3), π–π stacked chains in the (1/2) adduct with 4,4'-thiodiphenol, and pairwise-interwoven nets in 1,1,1-tris(4-hydroxyphenyl)ethane–1,10-phenanthroline–methanol (1/1/1) Acta Crystallographica Section B, 1999, 55, 591-600 |
| 2002979 | CIF HKL Paper | C60 H44 N6 O8 S2 | C 1 2/c 1 | 15.8692; 24.3728; 13.0952 90; 102.362; 90 | 4947.5 | Ferguson, George; Glidewell, Christopher; Lavender, Emma S. Crystal engineering using bisphenols and trisphenols. Complexes with 1,10-phenanthroline: hydrogen-bonded chains in adducts with 4,4'-biphenol (1/1) and 4,4'-sulfonyldiphenol (2/3), π–π stacked chains in the (1/2) adduct with 4,4'-thiodiphenol, and pairwise-interwoven nets in 1,1,1-tris(4-hydroxyphenyl)ethane–1,10-phenanthroline–methanol (1/1/1) Acta Crystallographica Section B, 1999, 55, 591-600 |
| 2002980 | CIF Paper | C33 H30 N2 O4 | P b c a | 22.811; 22.029; 10.7965 90; 90; 90 | 5425.3 | Ferguson, George; Glidewell, Christopher; Lavender, Emma S. Crystal engineering using bisphenols and trisphenols. Complexes with 1,10-phenanthroline: hydrogen-bonded chains in adducts with 4,4'-biphenol (1/1) and 4,4'-sulfonyldiphenol (2/3), π‒π stacked chains in the (1/2) adduct with 4,4'-thiodiphenol, and pairwise-interwoven nets in 1,1,1-tris(4-hydroxyphenyl)ethane‒1,10-phenanthroline‒methanol (1/1/1) Acta Crystallographica Section B, 1999, 55, 591-600 |
| 2002981 | CIF Paper | C5 H11 N O6 | P 21 21 21 | 7.301; 7.658; 13.855 90; 90; 90 | 774.6 | Rychlewska, Urszula; Szarecka, Agnieszka; Rychlewski, Jacek; Motała, Rafał A mediated hydrogen bond in an α-hydroxycarboxyl group: X-ray structure of (<i>R</i>,<i>R</i>)-<i>N</i>-methyltartramic acid monohydrate and an <i>ab initio</i> study of model systems Acta Crystallographica Section B, 1999, 55, 617-625 |
| 2002983 | CIF Paper | O7 V2 Zr | P a -3 | 26.296; 26.296; 26.296 90; 90; 90 | 18183.1 | Evans, J.S.O.; Hanson, J.C.; Sleight, A.W. Room-Temperature Superstructure of ZrV~2~O~7~ Acta Crystallographica Section B, 1998, 54, 705-713 |
| 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 |
| 2002985 | CIF Paper | C17 H22 N2 O3 | P -1 | 10.5; 11.617; 28.622 83.15; 83.41; 68.48 | 3215.2 | Kálmán, A.; Argay, Gy. Topological Description of Pseudosymmetries in <i>trans</i>-2,3,4,5,5a,6,7,8,9,9a-Decahydro-2-methyl-4-phenylaminocarbonylbenzo[<i>f</i>][1,4]oxazepin-3-one and Other Structures which Crystallize in Space Group <i>P</i>-1 with <i>Z</i> = 8 Acta Crystallographica Section B, 1998, 54, 877-888 |
| 2002986 | CIF HKL Paper | C51 H52 Cl N O13 | P 21 21 21 | 23.048; 34.383; 11.992 90; 90; 90 | 9503 | Cram, Donald J.; de Graaff, R. A. G.; Knobler, Carolyn B.; Lingenfelter, David S.; Maverick, Emily F.; Trueblood, Kenneth N. Chiral recognition between host and guest: a binaphthyl-18-crown-6 host with <small>D</small>-phenylglycinium methyl ester perchlorate guest. A difficult structure solved with <i>CRUNCH</i> Acta Crystallographica Section B, 1999, 55, 432-440 |
| 2002987 | CIF Paper | In1.4 Se2 Tl0.6 | I 4/m c m | 8.054; 8.054; 6.805 90; 90; 90 | 441.4 | Hatzisymeon, K. G.; Kokkou, S. C.; Anagnostopoulos, A. N.; Rentzeperis, P. I. X-ray Diffraction Study of the Crystal Structure of the Tl Ternary Chalcogenides Tl~2<i>x~</i>In~2(1{-~<i>x</i>)}Se~2~, <i>x</i> = 0.2, 0.3,···0.9 Acta Crystallographica Section B, 1998, 54, 358-364 |
| 2002988 | CIF Paper | In1.2 Se2 Tl0.8 | I 4/m c m | 8.056; 8.056; 6.826 90; 90; 90 | 443 | Hatzisymeon, K. G.; Kokkou, S. C.; Anagnostopoulos, A. N.; Rentzeperis, P. I. X-ray Diffraction Study of the Crystal Structure of the Tl Ternary Chalcogenides Tl~2<i>x~</i>In~2(1{-~<i>x</i>)}Se~2~, <i>x</i> = 0.2, 0.3,···0.9 Acta Crystallographica Section B, 1998, 54, 358-364 |
| 2002989 | CIF Paper | In0.8 Se2 Tl1.2 | I 4/m c m | 8.057; 8.057; 6.83 90; 90; 90 | 443.37 | Hatzisymeon, K. G.; Kokkou, S. C.; Anagnostopoulos, A. N.; Rentzeperis, P. I. X-ray Diffraction Study of the Crystal Structure of the Tl Ternary Chalcogenides Tl~2<i>x~</i>In~2(1{-~<i>x</i>)}Se~2~, <i>x</i> = 0.2, 0.3,···0.9 Acta Crystallographica Section B, 1998, 54, 358-364 |
| 2002990 | CIF Paper | C7 H8 N2 O2 | P 1 21/n 1 | 9.369; 5.563; 13.626 90; 92.36; 90 | 709.6 | Ellena, Javier; Goeta, Andrés E.; Howard, Judith A. K.; Wilson, Chick C.; Autino, Juan C.; Punte, Graciela Experimental evidence for the amino-group non-planarity in nitroanilines: neutron diffraction study of 2-methyl-5-nitroaniline at 100 K Acta Crystallographica, Section B: Structural Science, 1999, 55, 209-215 |
| 2002991 | CIF HKL Paper | C12 H26 N2 O4 | P 1 21 1 | 5.289; 12.6877; 11.4872 90; 95.8136; 90 | 766.887 | Görbitz, Carl Henrik; Torgersen, Eirin Symmetry, pseudosymmetry and packing disorder in the alcohol solvates of <small>L</small>-leucyl-<small>L</small>-valine Acta Crystallographica, Section B: Structural Science, 1999, 55, 104-113 |
| 2002992 | CIF HKL Paper | C13 H28 N2 O4 | P 1 21 1 | 11.0112; 23.5186; 12.2636 90; 90.0121; 90 | 3175.88 | Görbitz, Carl Henrik; Torgersen, Eirin Symmetry, pseudosymmetry and packing disorder in the alcohol solvates of <small>L</small>-leucyl-<small>L</small>-valine Acta Crystallographica, Section B: Structural Science, 1999, 55, 104-113 |
| 2002993 | CIF HKL Paper | C14 H30 N2 O4 | P 21 21 21 | 5.1709; 14.6136; 22.423 90; 90; 90 | 1694.4 | Görbitz, Carl Henrik; Torgersen, Eirin Symmetry, pseudosymmetry and packing disorder in the alcohol solvates of <small>L</small>-leucyl-<small>L</small>-valine Acta Crystallographica, Section B: Structural Science, 1999, 55, 104-113 |
| 2002994 | CIF Paper | C10 H8 I1.5 S8 | P -1 | 6.585; 9.038; 15.205 94.9; 95.74; 110 | 839.138 | Madsen, Dennis; Burghammer, Manfred; Fiedler, Stefan; Muller, Harald The single-crystal structure of the organic superconductor β~CO~-(BEDT-TTF)~2~I~3~ from a powder grain Acta Crystallographica Section B, 1999, 55, 601-606 |
| 2002995 | CIF HKL Paper | C8 H18 Cd O11 | P c c a | 7.304; 9.981; 19.956 90; 90; 90 | 1454.8 | Michaelides, O. A.; Tsaousis, D.; Skoulika, S.; Raptopoulou, C. P.; Terzis, A. An Unusual Hydrogen-Bonded Network Associated with Metal-Organic Chains: Structure and Crystal Packing of the Coordination Polymer [Cd(terephthalate)(H~2~O)~3~].4H~2~O Acta Crystallographica Section B, 1998, 54, 657-662 |
| 2002996 | CIF Paper | C8 H24 N2 O4 S | P 42/n m c :1 | 7.5355; 7.5355; 10.991 90; 90; 90 | 624.11 | Malchus, Michael; Jansen, Martin Structural Investigations of the Phase Transitions of Tetramethylammonium Sulfate Acta Crystallographica, Section B, 1998, 54, 494-502 |
| 2002997 | CIF Paper | C8 H24 N2 O4 S | P 4/n b m :1 | 10.8948; 10.8948; 10.789 90; 90; 90 | 1280.6 | Malchus, Michael; Jansen, Martin Structural Investigations of the Phase Transitions of Tetramethylammonium Sulfate Acta Crystallographica Section B, 1998, 54, 494-502 |
| 2002998 | CIF Paper | C57 H52 Cl O2 Os P3 | P 31 | 12.623; 12.623; 26.325 90; 90; 120 | 3632.7 | Herbst-Irmer, Regine; Sheldrick, George M. Refinement of Twinned Structures with <i>SHELXL</i>97 Acta Crystallographica Section B, 1998, 54, 443-449 |
| 2002999 | CIF Paper | O20 P4 Ti5 | P 21 21 21 | 12.8417; 14.4195; 7.4622 90; 90; 90 | 1381.8 | Glaum, Robert; Reinauer, Felix Ideal and Real Structure of Ti~5~O~4~(PO~4~)~4~: X-ray and HRTEM Investigations Acta Crystallographica Section B, 1998, 54, 722-731 |
| 2003000 | CIF Paper | C19 H18 O4 | P 1 | 8.075; 8.871; 11.606 72.69; 80.07; 71.84 | 751.3 | Walker, Martina; Pohl, Ehmke; Herbst-Irmer, Regine; Gerlitz, Martin; Rohr, Jürgen; Sheldrick, George M. Absolute configurations of Emycin D, E and F; mimicry of centrosymmetric space groups by mixtures of chiral stereoisomers Acta Crystallographica Section B, 1999, 55, 607-616 |
| 2003001 | CIF Paper | C33 H24 Br2 O6 | P 1 21 1 | 7.796; 7.914; 22.243 90; 92.12; 90 | 1371.4 | Walker, Martina; Pohl, Ehmke; Herbst-Irmer, Regine; Gerlitz, Martin; Rohr, Jürgen; Sheldrick, George M. Absolute configurations of Emycin D, E and F; mimicry of centrosymmetric space groups by mixtures of chiral stereoisomers Acta Crystallographica Section B, 1999, 55, 607-616 |
| 2003002 | CIF Paper | C26 H19 Br O5 | P 1 | 8.279; 11.539; 11.962 101.32; 110.25; 92.76 | 1042.9 | Walker, Martina; Pohl, Ehmke; Herbst-Irmer, Regine; Gerlitz, Martin; Rohr, Jürgen; Sheldrick, George M. Absolute configurations of Emycin D, E and F; mimicry of centrosymmetric space groups by mixtures of chiral stereoisomers Acta Crystallographica Section B, 1999, 55, 607-616 |
| 2003003 | CIF Paper | ? | P 4 21 2 | 23.808; 23.808; 23.14 90; 90; 90 | 13116 | Steiner, T.; Saenger, W. Channel-Type Crystal Packing in the Very Rare Space Group <i>P</i>42~1~2 with <i>Z</i>' = 3/4: Crystal Structure of the Complex γ-Cyclodextrin‒Methanol‒<i>n</i>-Hydrate Acta Crystallographica Section B, 1998, 54, 450-455 |
| 2003004 | CIF | O80 P4 W24 | P 21 21 21 | 5.312; 6.5557; 42.196 90; 90; 90 | 1469.5 | Roussel, P.; Mather, G.; Domengès, B.; Groult, D.; Labbé, P. Structural Investigation of P~4~W~24~O~80~: A New Monophosphate Tungsten Bronze Acta Crystallographica, Section B: Structural Science, 1998, 54, 365-375 |
| 2003005 | CIF Paper | Ag7 P Se6 | P 21 3 | 10.772; 10.772; 10.772 90; 90; 90 | 1249.9 | Evain, M.; Gaudin, E.; Boucher, F.; Petricek, V.; Taulelle, F. Structures and Phase Transitions of the <i>A</i>~7~PSe~6~ (<i>A</i> = Ag, Cu) Argyrodite-Type Ionic Conductors. I. Ag~7~PSe~6~ Acta Crystallographica Section B, 1998, 54, 376-383 |
| 2003006 | CIF Paper | Ag7 P Se6 | F -4 3 m | 10.838; 10.838; 10.838 90; 90; 90 | 1273.1 | Evain, M.; Gaudin, E.; Boucher, F.; Petricek, V.; Taulelle, F. Structures and Phase Transitions of the <i>A</i>~7~PSe~6~ (<i>A</i> = Ag, Cu) Argyrodite-Type Ionic Conductors. I. Ag~7~PSe~6~ Acta Crystallographica Section B, 1998, 54, 376-383 |
| 2003007 | CIF Paper | D2 O4 P Tl | P 1 1 21/b | 9.07; 15; 6.575 90; 90; 106.92 | 855.8 | Ríos, Susana; Paulus, Werner; Cousson, Alain; Quilichini, Marguerite; Heger, Gernot Isotope Effect in TlH~2~PO~4~ and TlD~2~PO~4~ Acta Crystallographica Section B, 1998, 54, 790-797 |
| 2003008 | CIF | C8 H24 P4 S8 Th | P 42 21 2 | 10.386; 10.386; 11.742 90; 90; 90 | 1266.6 | Iversen, B. B.; Larsen, F. K.; Pinkerton, A. A.; Martin, A.; Darovsky, A.; Reynolds, P. A. Accurate charge densities in days ‒ use of synchrotrons, image plates and very low temperatures Acta Crystallographica, Section B: Structural Science, 1999, 55, 363-374 |
| 2003009 | CIF | C8 H24 P4 S8 Th | P 42 21 2 | 10.42; 10.42; 11.784 90; 90; 90 | 1279 | Iversen, B. B.; Larsen, F. K.; Pinkerton, A. A.; Martin, A.; Darovsky, A.; Reynolds, P. A. Accurate charge densities in days ‒ use of synchrotrons, image plates and very low temperatures Acta Crystallographica, Section B: Structural Science, 1999, 55, 363-374 |
| 2003010 | CIF | C8 H24 P4 S8 Th | P 42 21 2 | 10.42; 10.42; 11.784 90; 90; 90 | 1279 | Iversen, B. B.; Larsen, F. K.; Pinkerton, A. A.; Martin, A.; Darovsky, A.; Reynolds, P. A. Accurate charge densities in days ‒ use of synchrotrons, image plates and very low temperatures Acta Crystallographica, Section B: Structural Science, 1999, 55, 363-374 |
| 2003011 | CIF | C8 H24 P4 S8 Th | P 42 21 2 | 10.386; 10.386; 11.742 90; 90; 90 | 1266.6 | Iversen, B. B.; Larsen, F. K.; Pinkerton, A. A.; Martin, A.; Darovsky, A.; Reynolds, P. A. Accurate charge densities in days ‒ use of synchrotrons, image plates and very low temperatures Acta Crystallographica, Section B: Structural Science, 1999, 55, 363-374 |
| 2003012 | CIF | K Nb5 O15 Pb2 | P 4/m b m | 12.646; 12.646; 3.9551 90; 90; 90 | 632.5 | Sciau, Philippe; Calvarin, Gilbert; Ravez, Jean Structures des phases paraélectrique et ferroélectrique de Pb~2~KNb~5~O~15~ Acta Crystallographica Section B, 1999, 55, 459-466 |
| 2003013 | CIF | K Nb5 O15 Pb2 | P 4/m b m | 12.646; 12.646; 3.9551 90; 90; 90 | 632.5 | Sciau, Philippe; Calvarin, Gilbert; Ravez, Jean Structures des phases paraélectrique et ferroélectrique de Pb~2~KNb~5~O~15~ Acta Crystallographica Section B, 1999, 55, 459-466 |
| 2003014 | CIF | K Nb5 O15 Pb2 | C m 2 m | 17.779; 18.015; 3.9209 90; 90; 90 | 1255.82 | Sciau, Philippe; Calvarin, Gilbert; Ravez, Jean Structures des phases paraélectrique et ferroélectrique de Pb~2~KNb~5~O~15~ Acta Crystallographica Section B, 1999, 55, 459-466 |
| 2003015 | CIF | K Nb5 O15 Pb2 | C m 2 m | 17.756; 18.019; 3.9141 90; 90; 90 | 1252.3 | Sciau, Philippe; Calvarin, Gilbert; Ravez, Jean Structures des phases paraélectrique et ferroélectrique de Pb~2~KNb~5~O~15~ Acta Crystallographica Section B, 1999, 55, 459-466 |
| 2003016 | CIF Paper | C6 H14 I2 N2 O2 Zn | C 1 2/c 1 | 14.005; 13.697; 15.755 90; 110.88; 90 | 2824 | Edwards, R. A.; Easteal, A. J.; Gladkikh, O. P.; Robinson, W. T.; Turnbull, M. M.; Wilkins, C. J. A Reversible Non-disruptive Phase Transition Shown by the Zinc Iodide Dimethylformamide Complex ZnI~2~(dmf)~2~ Acta Crystallographica Section B, 1998, 54, 663-670 |
| 2003017 | CIF Paper | C6 H14 I2 N2 O2 Zn | P 1 21/n 1 | 13.819; 13.543; 15.559 90; 110.29; 90 | 2731.2 | Edwards, R. A.; Easteal, A. J.; Gladkikh, O. P.; Robinson, W. T.; Turnbull, M. M.; Wilkins, C. J. A Reversible Non-disruptive Phase Transition Shown by the Zinc Iodide Dimethylformamide Complex ZnI~2~(dmf)~2~ Acta Crystallographica Section B, 1998, 54, 663-670 |
| 2003018 | CIF Paper | C4 H6 N2 O2 | P 1 21/c 1 | 5.941; 10.08; 8.282 90; 95.87; 90 | 493.4 | Lenstra; Bracke; Van Dijk; Maes; Vanhulle; Desseyn Net Intensities: Accuracy Improvement Through a Bayesian Perspective on the Measuring Strategy and Their Persistent Lack of Precision. An Illustration Acta Crystallographica Section B, 1998, 54, 851-858 |
| 2003019 | CIF Paper | C21 H15 Bi O6 | P 1 21/m 1 | 7.858; 14.442; 16.807 90; 92.26; 90 | 1905.9 | Rae, A. D.; Gainsford, G. J.; Kemmitt, T. Disordered Structure of Polymeric Bismuth Tribenzoate, [Bi(C~6~H~5~COO)~3~]~<i>n~</i> Acta Crystallographica Section B, 1998, 54, 438-442 |
| 2003020 | CIF Paper | B2 Ba O2 | R 3 | 12.532; 12.532; 12.717 90; 90; 120 | 1729.64 | Xue, D. F.; Zhang, S. Y. Structure and Non-linear Optical Properties of β -Barium Borate Acta Crystallographica Section B, 1998, 54, 652-656 |
| 2003021 | CIF | Ca8 Ga8 H8 O32 Si4 | I -4 3 m | 8.9346; 8.9346; 8.9346 90; 90; 90 | 713.22 | Binsted, N.; Dann, S.E.; Pack, M.J.; Weller, M.T. Acta Crystallographica, Section B, 1998, 54, 558-563 |
| 2003022 | CIF | Ca8 Ga8 H8 O32 Si4 | I -4 | 8.9346; 8.9346; 8.9346 90; 90; 90 | 713.22 | Binsted, N.; Dann, S.E.; Pack, M.J.; Weller, M.T. Acta Crystallographica, Section B, 1998, 54, 558-563 |
| 2003023 | CIF | Ca8 Ga8 H8 O32 Si4 | I -4 | 8.9345; 8.9345; 8.9345 90; 90; 90 | 713.2 | Binsted, N.; Dann, S.E.; Pack, M.J.; Weller, M.T. Acta Crystallographica, Section B, 1998, 54, 558-563 |
| 2003024 | CIF Paper | C14 H10 N2 O2 | P 1 21/a 1 | 12.083; 18.854; 10.76 90; 107.29; 90 | 2340.5 | Becker, Dan; Botoshansky, Mark; Gasper, Noga; Herbstein, Frank H.; Karni, Miriam 2-Phenyl-4-hydroxyphthalazin-1-one: A Benzoannelated Derivative of Maleic Hydrazide Acta Crystallographica Section B, 1998, 54, 671-676 |
| 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 |
| 2003026 | CIF Paper | K2 O5 Si2 | C 1 c 1 | 16.3224; 11.243; 9.919 90; 115.972; 90 | 1636.4 | 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 |
| 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 |
| 2003028 | CIF Paper | C44 H60 Zr | I -4 | 16.481; 16.481; 7.131 90; 90; 90 | 1936.9 | Tedesco, C.; Immirzi, A.; Proto, A. Structures of Homoleptic Benzyl Derviatives of Zirconium Acta Crystallographica Section B, 1998, 54, 431-437 |
| 2003029 | CIF Paper | C28 H28 Zr | P b c a | 16.387; 20.022; 13.758 90; 90; 90 | 4514 | Tedesco, C.; Immirzi, A.; Proto, A. Structures of Homoleptic Benzyl Derviatives of Zirconium Acta Crystallographica Section B, 1998, 54, 431-437 |
| 2003030 | CIF Paper | C16 H12 N2 | P 1 21/c 1 | 4.0246; 15.5147; 9.1453 90; 101.23; 90 | 560.1 | Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Piantanida, Ivo Crystal and molecular structures of diazapyrenes and a study of π···π interactions Acta Crystallographica Section B, 1999, 55, 55-69 |
| 2003031 | CIF Paper | C16 H12 N2 | C 1 2/m 1 | 12.4968; 11.4751; 3.9615 90; 96.8; 90 | 564.09 | Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Piantanida, Ivo Crystal and molecular structures of diazapyrenes and a study of π···π interactions Acta Crystallographica Section B, 1999, 55, 55-69 |
| 2003032 | CIF HKL Paper | C20.36 H23.72 Cl2 N3 O3.68 | P 1 21/c 1 | 8.23; 35.82; 8.042 90; 103.11; 90 | 2309 | Pani, M.; Carnasciali, M. M.; Mugnoli, A.; Beltrame, P.; Cadoni, E.; Gelli, G. Energetic Study of the Disordered Solvent in the Crystal Structure of an Isoxazole Derivative Acta Crystallographica Section B, 1998, 54, 872-876 |
| 2003033 | CIF Paper | C51 H98 O6 | P -1 | 5.4514; 11.945; 40.482 84.662; 86.97; 79.77 | 2581.1 | A.J. van Langevelde Structure of mono-acid even-numbered β-triacylglycerols Acta Crystallographica Section B, 1999, 55, 114-122 |
| 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 |
| 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 |
| 2003037 | CIF HKL Paper | C22 H28 O | P 1 21/n 1 | 13.293; 16.657; 8.944 90; 93.09; 90 | 1977.5 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
| 2003038 | CIF HKL Paper | C23 H30 O2 | P 1 21/n 1 | 10.765; 17.292; 11.228 90; 91.61; 90 | 2089.2 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
| 2003039 | CIF HKL Paper | C23 H27 Cl O2 | P 1 21/c 1 | 10.915; 17.606; 11.629 90; 108.49; 90 | 2119.4 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
| 2003040 | CIF HKL Paper | C24 H30 O3 | P 1 21/n 1 | 11.274; 13.348; 14.786 90; 95.67; 90 | 2214.2 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
| 2003041 | CIF HKL Paper | C23 H30 O | P 1 21/n 1 | 10.789; 14.804; 13.528 90; 104.62; 90 | 2090.7 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
| 2003042 | CIF HKL Paper | C26 H36 O | P 1 21/n 1 | 10.033; 22.856; 11.227 90; 113.73; 90 | 2356.8 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
| 2003043 | CIF HKL Paper | C23 H30 O2 | P 1 21/c 1 | 9.312; 12.005; 18.804 90; 90; 90 | 2102.1 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
| 2003044 | CIF Paper | C23 H28 O3 | P -1 | 11.71; 15.01; 6.224 95.55; 97.05; 77.79 | 1058.3 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
| 2003045 | CIF HKL Paper | C23 H27 Cl O2 | P c a b | 17.466; 20.537; 11.749 90; 90; 90 | 4214.4 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
| 2003046 | CIF Paper | C24 H30 O3 | P -1 | 8.679; 20.893; 6.16 93.96; 103.14; 78.22 | 1064.5 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
| 2003047 | CIF Paper | C25 H32 O3 | P -1 | 10.83; 12.717; 9.379 104.53; 99.15; 105.14 | 1171.6 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
| 2003048 | CIF HKL Paper | C33 H39 N O4 | P 21 21 21 | 10.798; 30.042; 9.407 90; 90; 90 | 3051.6 | Hosomi, H.; Ito, Y.; Ohba, S. Crystal-to-Crystal Diastereoselective Transformation of 2,4,6-Triisopropyl-4'-(<i>S</i>)-phenylalaninocarbonylbenzophenone Methyl Ester Acta Crystallographica Section B, 1998, 54, 907-911 |
| 2003049 | CIF HKL Paper | C33 H39 N O4 | P 21 21 21 | 11.525; 28.238; 9.317 90; 90; 90 | 3032 | Hosomi, H.; Ito, Y.; Ohba, S. Crystal-to-Crystal Diastereoselective Transformation of 2,4,6-Triisopropyl-4'-(<i>S</i>)-phenylalaninocarbonylbenzophenone Methyl Ester Acta Crystallographica Section B, 1998, 54, 907-911 |
| 2003050 | CIF HKL Paper | C24 H30 O3 | P 21 n b | 11.691; 17.51; 10.683 90; 90; 90 | 2186.9 | Hosomi, H.; Ito, Y.; Ohba, S. Crystal-to-Crystal Diastereoselective Transformation of 2,4,6-Triisopropyl-4'-(<i>S</i>)-phenylalaninocarbonylbenzophenone Methyl Ester Acta Crystallographica Section B, 1998, 54, 907-911 |
| 2003051 | CIF HKL Paper | C6 H6 N2 O | P 1 21/c 1 | 3.877; 15.6; 9.375 90; 98.45; 90 | 560.9 | Yoshihisa Miwa; Takashi Mizuno; Kazunori Tsuchida; Tooru Taga; Yutaka Iwata Experimental charge density and electrostatic potential in nicotinamide Acta Crystallographica Section B, 1999, 55, 78-84 |
| 2003052 | CIF | C6 H6 N2 O | P 1 21/c 1 | 3.975; 15.632; 9.422 90; 99.03; 90 | 578.2 | Yoshihisa Miwa; Takashi Mizuno; Kazunori Tsuchida; Tooru Taga; Yutaka Iwata Experimental Charge Density and Electrostatic Potential in Nicotinamide Acta Crystallographica, Section B, 1999, 55, 78-84 |
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