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 |
---|---|---|---|---|---|---|
2107217 | CIF | K2 O3 Te | P -3 | 6.279; 6.279; 7.069 90; 90; 120 | 241.362 | Andersen, L.; Langer, V.; Stroemberg, A.; Stroemberg, D. The structure of K2 Te O3 - an experimental and theoretical study Acta Crystallographica B (39,1983-), 1989, 45, 344-348 |
2107218 | CIF | C2 B2 La | P -4 2 c | 3.8218; 3.8218; 7.9237 90; 90; 90 | 115.735 | Bauer, J.; Bars, O. The ordering of boron and carbon atoms in the La B2 C2 structure Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1540-1544 |
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 |
2107220 | CIF | Al11 Cd0.61 O17.11 | P 63/m m c | 5.5869; 5.5869; 22.37 90; 90; 120 | 604.698 | Edstroem, K.; Thomas, J.O.; Farrington, G.C. Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Acta Crystallographica B (39,1983-), 1991, 47, 635-643 |
2107221 | CIF | Cs D1.17 O4 S | I 41/a m d :2 | 5.74147; 5.74147; 14.31508 90; 90; 90 | 471.889 | Belushkin, A. V.; David, W. I. F.; Shuvalov, L. A.; Ibberson, R. M. High-resolution neutron powder diffraction studies of the structure of CsDSO4 Acta Crystallographica B (39,1983-), 1991, 47, 161-166 |
2107222 | CIF | Er9 La10 S27 | C 1 2/m 1 | 29.71; 3.941; 25.92 90; 134.4; 90 | 2168.35 | Carre, D.; Laruelle, P. Structure cristalline du sulfure d'erbium et de lanthane, Er9 La10 S27 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 70-73 |
2107223 | CIF | In5 S12 Tb3 | P 1 21/m 1 | 21.259; 3.897; 10.998 90; 96.36; 90 | 905.536 | Carre, D. Structure cristalline du sulfure d'indium et de terbium Tb3 In5 S12 Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1163-1166 |
2107224 | CIF | Cl5 Co Cs3 | I 4/m c m | 9.123; 9.123; 14.499 90; 90; 90 | 1206.74 | Figgis, B.N.; Kucharski, E.S.; Reynolds, P.A. Electron density distribution in Cs3 Co Cl5 Acta Crystallographica B (39,1983-), 1989, 45, 232-240 |
2107225 | CIF | C6 H17 Co Cr N11 O | R -3 :H | 10.968; 10.968; 10.788 90; 90; 120 | 1123.9 | Figgis, B.N.; Kucharski, E.S.; Vrtis, M. Structure of pentaammineaquacobalt(III) hexacyanochromate (III), (Co(NH3)5(H2O))(Cr(CN)6), by neutron diffraction at 2.0 K Acta Crystallographica B (39,1983-), 1991, 47, 858-861 |
2107226 | CIF | Ca3.93 H O13 P3 Pb1.07 | P 63/m | 9.491; 9.491; 6.953 90; 90; 120 | 542.409 | Bigi, A.; Ripamonti, A.; Thomas, S.A.; Brueckner, S.; Roveri, N.; Gazzano, M. Structure refinements of lead-substituted calcium hydroxyapatite by x-ray powder fitting Acta Crystallographica B (39,1983-), 1989, 45, 247-251 |
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 |
2107228 | CIF | Ca2.79 H O13 P3 Pb2.21 | P 63/m | 9.609; 9.609; 7.077 90; 90; 120 | 565.895 | Bigi, A.; Ripamonti, A.; Brueckner, S.; Gazzano, M.; Thomas, S.A.; Roveri, N. Structure refinement of lead-substituted calcium hydroxyapatite by x-ray powder fitting Acta Crystallographica B (39,1983-), 1989, 45, 247-251 |
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 |
2107230 | CIF | Ca0.81 H O13 P3 Pb4.19 | P 63/m | 9.769; 9.769; 7.32 90; 90; 120 | 604.981 | Bigi, A.; Brueckner, S.; Ripamonti, A.; Gazzano, M.; Roveri, N.; Thomas, S.A. Structure refinement of lead-substituted calcium hydroxyapatite by x-ray powder fitting Acta Crystallographica B (39,1983-), 1989, 45, 247-251 |
2107231 | CIF | La2.98364 Mn S5.45455 | C 1 m 1 | 16.65; 14.082; 17.82 90; 143.3; 90 | 2496.98 | Collin, G.; Laruelle, P. Structure cristalline de La32,66 M11 S6 (M= Mn, Fe) Acta Crystallographica B (24,1968-38,1982), 1974, 30, 1134-1139 |
2107232 | CIF | Cu5 S7 Si2 | C 1 c 1 | 16.216; 6.317; 9.597 90; 92.38; 90 | 982.235 | Dogguy, M.; Rivet, J.; Jaulmes, S.; Laruelle, P. Structure du sulfure de cuivre et de silicium Cu5 Si2 S7 Acta Crystallographica B (24,1968-38,1982), 1982, 38, 2014-2016 |
2107233 | CIF | Ca5.14 F0.97 O12.246 P3 Sb0.092 | P 63/m | 9.375; 9.375; 6.8904 90; 90; 120 | 524.466 | de Boer, B.G.; Young, R.A.; Cagle, J.R.; Sakthivel, A. Determination of the antimony substitution site in calcium fluorapatite from powder x-ray diffraction data Acta Crystallographica B (39,1983-), 1991, 47, 683-692 |
2107234 | CIF | Ca5.17 F1.04 O12.414 P3 Sb0.14 | P 63/m | 9.3713; 9.3713; 6.8866 90; 90; 120 | 523.763 | de Boer, B.G.; Sakthivel, A.; Cagle, J.R.; Young, R.A. Determination of the antimony substitution site in calcium fluorapatite from powder x-ray diffraction data Acta Crystallographica B (39,1983-), 1991, 47, 683-692 |
2107235 | CIF | Al2 Ca O8 Si2 | P -1 | 8.186; 12.876; 14.182 93.3; 115.79; 91.12 | 1342.05 | Bruno, E.; Chiari, G.; Facchinelli, A. Anorthite quenched from 1530 grad celsius. I. Structure refinement Acta Crystallographica B (24,1968-38,1982), 1976, 32, 3270-3279 |
2107236 | CIF | Ba2 Cu3 O6.54 Y | P m m m | 3.847; 3.875; 11.7 90; 90; 90 | 174.413 | Buttner, R.H.; Maslen, E.N.; Spadaccini, N. A position-space model for superconductivity in YBa2Cu3O7-x Acta Crystallographica B (39,1983-), 1992, 48, 21-30 |
2107237 | CIF | Ba2 Cu3 O6.78 Y | P m m m | 3.842; 3.886; 11.69 90; 90; 90 | 174.532 | Buttner, R.H.; Maslen, E.N.; Spadaccini, N. A position-space model for superconductivity in Y Ba2 Cu3 O7-x Acta Crystallographica B (39,1983-), 1992, 48, 21-30 |
2107238 | CIF | C2 H30 Cl4 Co3 N12 Na O24 | A 1 2 1 | 14.114; 7.864; 14.843 90; 112.3; 90 | 1524.25 | Weiss, J.; Siebert, H.; Wieghardt, K. Die Kristall- und Molekuelstruktur von (Co3 (N H3)8 (O H)2 (N O2)2 (C N)2) (Cl O4)3 (Na Cl O4) (H2 O)2 Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1709-1712 |
2107239 | CIF | Cr F6 H18 Mn N6 | P a -3 | 10.059; 10.059; 10.059 90; 90; 90 | 1017.8 | Wieghardt, K.; Weiss, J. Die Kristallstrukturen von Hexamminchrom(III) Hexafluoromanganat(III) und Hexamminchrom(III) Hexafluoroferrat(III) Acta Crystallographica B (24,1968-38,1982), 1972, 28, 529-534 |
2107240 | CIF | Cr F6 Fe H18 N6 | P a -3 | 10.079; 10.079; 10.079 90; 90; 90 | 1023.89 | Wieghardt, K.; Weiss, J. Die Kristallstrukturen von Hexamminchrom(III) Hexafluoromanganat(III) und Hexamminchrom(III) Hexafluoroferrat(III) Acta Crystallographica B (24,1968-38,1982), 1972, 28, 529-534 |
2107241 | CIF | Al14 Ca12 F2 O32 | I -4 3 d | 11.97; 11.97; 11.97 90; 90; 90 | 1715.07 | Williams, P.P. Refinement of the structure of (Ca O)11 (Al2 O3)7 Ca F2 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 1550-1551 |
2107242 | CIF | Ba2 O4 Ti | P 1 21/n 1 | 6.096; 7.681; 10.545 90; 92.99; 90 | 493.08 | Wu, K.K.; Brown, I.D. The crystal structure of beta-barium orthotitanate, beta-Ba Ti O4, and the bond strength-bond length curve of Ti-O Acta Crystallographica B (24,1968-38,1982), 1973, 29, 2009-2012 |
2107243 | CIF | H10 N2 O6 P2 Sn | P -1 | 4.799; 10.06; 10.338 107.07; 82.18; 90.32 | 472.363 | Yamaguchi, T.; Lindqvist, O. The Structure of Diammonium Tin(II) Diphosphite, (N H4)2 Sn (H P O3)2 Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1441-1445 |
2107244 | CIF | Cl2 N4 S4 | P 1 21/c 1 | 9.077; 6.58; 13.311 90; 108.46; 90 | 754.114 | Zak, Z. The Structure of 1.5-Dichlorocyclotetra(azathiene) Acta Crystallographica B (24,1968-38,1982), 1981, 37, 23-26 |
2107245 | CIF | Br6 N3 P3 | P n m a | 14.463; 13.41; 6.601 90; 90; 90 | 1280.26 | Zoer, H.; Wagner, A.J. The Crystal Structure of Compounds with (N-P)n Rings. VII. Refinement of the Crystal Structure of Hexabromo-cyclotriphosphazene, N3 P3 Br6 Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1812-1819 |
2107246 | CIF | Br8 N4 P4 | P 42/n :2 | 11.187; 11.187; 6.189 90; 90; 90 | 774.547 | Zoer, H.; Wagner, A.J. The crystal structure of compounds with (N-P)n rings. IX. Octabromocyclotetraphosphazene, N4 P4 Br8 Acta Crystallographica B (24,1968-38,1982), 1972, 28, 252-257 |
2107247 | CIF | Al4 Li9 | C 1 2/m 1 | 19.1551; 4.4988; 18.2554 90; 163.54; 90 | 445.748 | Hansen, D.A.; Smith, J.F. The structure of Li9 Al4 Acta Crystallographica B (24,1968-38,1982), 1968, 24, 913-918 |
2107248 | CIF | O7 V4 | P -1 | 5.504; 7.007; 10.243 41.3; 72.5; 109.4 | 115.016 | Horiuchi, H.; Tokonami, M.; Nagasawa, K.; Morimoto, N. The crystal structure of V4 O7 Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1404-1410 |
2107249 | CIF | Fe3 O4 | P b c m | 11.868; 11.851; 16.752 90; 90; 90 | 2356.13 | Iizumi, M.; Koetzle, T.F.; Chikazumi, S.; Shirane, G.; Matsui, M.; Todo, S. Structure of magnetite (Fe3 O4) below the Verwey transition temperature Acta Crystallographica B (24,1968-38,1982), 1982, 38, 2121-2133 |
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 |
2107251 | CIF | Bi2 S5 Tl4 | P n m a | 16.76; 4.09; 17.396 90; 90; 90 | 1192.47 | Julien-Pouzol, M.; Jaulmes, S.; Laruelle, P. Structure cristalline du sulfure de bismuth et thallium Tl4 Bi2 S5 Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1313-1315 |
2107252 | CIF | Ga Te | C 1 2/m 1 | 17.404; 4.077; 17.93 90; 145.61; 90 | 718.592 | Julien-Pouzol, M.; Jaulmes, S.; Guittard, M.; Alapini, F. Monotellurure de gallium, Ga Te Acta Crystallographica B (24,1968-38,1982), 1979, 35, 2848-2851 |
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 |
2107254 | CIF | Ga La S3 | P 1 21/c 1 | 15.17; 10.56; 12.82 90; 137.7; 90 | 1382.17 | Julien-Pouzol, M.; Jaulmes, S.; Dagron, C. Structure du trisulfure de lanthane et de gallium Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1566-1568 |
2107255 | CIF | Nb2 Se3 | P 1 21/m 1 | 6.503; 3.434; 9.215 90; 103.39; 90 | 200.189 | Kadijk, F.; Huisman, R.; Jellinek, F. The crystal structures of niobium(III) selenide and tantalum(III) selenide Acta Crystallographica B (24,1968-38,1982), 1968, 24, 1102-1106 |
2107256 | CIF | Cd2 H2 O6 S | P 1 21/n 1 | 6.9; 7.567; 9.964 90; 97.17; 90 | 516.175 | Labarre, J.; Louer, D.; Louer, M.; Grandjean, D. Etude structurale des hydroxysulfates de cadmium. II. Structure cristalline de Cd2 (O H)2 S O4-gamma Acta Crystallographica B (24,1968-38,1982), 1976, 32, 3253-3257 |
2107257 | CIF | O13 V6 | P 1 21/c 1 | 14.1; 3.713; 11.96 90; 135.5; 90 | 438.871 | Kawada, I.; Ishii, M.; Nakano-Onoda, M.; Saeki, M.; Kimizuka, N.; Kato, K. Structural re-investigation of the low-temperature phase of V6 O13 Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1037-1039 |
2107258 | CIF | F6 H3 O Sb | I 21 3 | 10.12; 10.12; 10.12 90; 90; 90 | 1036.43 | Larson, E.M.; Larson, A.C.; Abney, K.D.; Eller, P.G. Structure of oxonium hexafluoroantimonate(V) Acta Crystallographica B (39,1983-), 1991, 47, 206-209 |
2107259 | CIF | D4 F N | P 63 m c | 4.436; 4.436; 7.158 90; 90; 120 | 121.985 | Lawson, A.C.jr.; Roof, R.B.jr.; Jorgensen, J.D.; Schirber, J.E.; Morosin, B. Structure of N D4 F - II Acta Crystallographica B (39,1983-), 1989, 45, 212-218 |
2107260 | CIF | D4 F N | R 3 c :H | 8.508; 8.508; 16.337 90; 90; 120 | 1024.14 | Lawson, A.C.jr.; Roof, R.B.jr.; Morosin, B.; Jorgensen, J.D.; Schirber, J.E. Structure of N D4 F - II Acta Crystallographica B (39,1983-), 1989, 45, 212-218 |
2107261 | CIF | Ca Cd2 Cl6 H12 O6 | P -1 | 11.137; 7.693; 9.387 90.07; 111.1; 99.93 | 737.331 | Leligny, H.; Monier, J.C. Structure de l'hexachlorure de dicadmium et de calcium hexahydrate, 2(Ca (H2 O)6 Cl)(Cd4 Cl10)inf. Mise en evidence d'une macle repetee (010) Acta Crystallographica B (39,1983-), 1989, 45, 113-117 |
2107262 | CIF | Ca Cd5 Cl12 H23 O11.5 | P -1 | 11.086; 7.6783; 9.3783 89.96; 111.32; 100 | 730.668 | Leligny, H.; Monier, J.C. Structure du dodecachlorure de pentacadmium et de calcium 11.5-hydrate, (Ca (H2 O)8)(Cd5 Cl12 (H2 O)2i nf (H2 O)1.5. Desordres planaires(100) - modulation (100) Acta Crystallographica B (39,1983-), 1989, 45, 117-124 |
2107263 | CIF | Ce H2 O6 S | P 21 21 21 | 11.987; 8.272; 4.331 90; 90; 90 | 429.447 | Lindgren, O. Cerium(IV) oxide sulphate hydrate, a new refinement Acta Crystallographica B (24,1968-38,1982), 1976, 32, 3347-3348 |
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 |
2107265 | CIF | Ba2 O8 Si2 Ti | P 4 b m | 8.642; 8.642; 5.63 90; 90; 90 | 420.472 | 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 |
2107266 | CIF HKL Paper | Li0.5 Mn2 O4 | P 21 3 | 8.152889; 8.152889; 8.152889 90; 90; 90 | 541.919 | Bianchini, Matteo; Fauth, François; Suard, Emmanuelle; Leriche, Jean-Bernard; Masquelier, Christian; Croguennec, Laurence Spinel materials for Li-ion batteries: new insights obtained by <i>operando</i> neutron and synchrotron X-ray diffraction Acta Crystallographica Section B, 2015, 71 |
2107267 | CIF HKL Paper | C5.6 H7.2 Cl0.8 I1.6 N0.8 Pb0.4 | P 1 21 1 | 8.5992; 8.9125; 15.8039 90; 95.502; 90 | 1205.64 | Weber, Oliver J.; Marshall, Kayleigh L.; Dyson, Lewis M.; Weller, Mark T. Structural diversity in hybrid organic‒inorganic lead iodide materials Acta Crystallographica Section B, 2015, 71, 668-678 |
2107268 | CIF HKL | C10 H10 I4 N2 Pb | I 1 2/a 1 | 7.7839; 14.1821; 15.3644 90; 90.434; 90 | 1696.06 | Weber, Oliver J.; Marshall, Kayleigh L.; Dyson, Lewis M.; Weller, Mark T. Structural diversity in hybrid organic‒inorganic lead iodide materials Acta Crystallographica Section B, 2015, 71, 668-678 |
2107269 | CIF HKL | C7.47 H11.73 I3.2 N1.07 O1.07 Pb1.07 S1.07 | P b c a | 8.0519; 23.4398; 32.8901 90; 90; 90 | 6207.51 | Weber, Oliver J.; Marshall, Kayleigh L.; Dyson, Lewis M.; Weller, Mark T. Structural diversity in hybrid organic‒inorganic lead iodide materials Acta Crystallographica Section B, 2015, 71, 668-678 |
2107270 | CIF HKL | C18 H26 I6 N4 O2 Pb2 | P 1 21/c 1 | 11.8465; 17.6887; 8.1762 90; 98.798; 90 | 1693.16 | Weber, Oliver J.; Marshall, Kayleigh L.; Dyson, Lewis M.; Weller, Mark T. Structural diversity in hybrid organic‒inorganic lead iodide materials Acta Crystallographica Section B, 2015, 71, 668-678 |
2107271 | CIF HKL | C10 H18 I3 N O2 Pb S2 | P 1 21/c 1 | 15.0068; 16.9568; 8.1667 90; 95.491; 90 | 2068.6 | Weber, Oliver J.; Marshall, Kayleigh L.; Dyson, Lewis M.; Weller, Mark T. Structural diversity in hybrid organic‒inorganic lead iodide materials Acta Crystallographica Section B, 2015, 71, 668-678 |
2107272 | CIF HKL | C3 H5 I3 N2 Pb | P 63/m | 15.5643; 15.5643; 8.0123 90; 90; 120 | 1680.92 | Weber, Oliver J.; Marshall, Kayleigh L.; Dyson, Lewis M.; Weller, Mark T. Structural diversity in hybrid organic‒inorganic lead iodide materials Acta Crystallographica Section B, 2015, 71, 668-678 |
2107273 | CIF HKL | C3.2 H9.6 I2.4 N1.6 Pb0.4 | P 1 2/n 1 | 9.8058; 9.2603; 12.4081 90; 93.553; 90 | 1124.55 | Weber, Oliver J.; Marshall, Kayleigh L.; Dyson, Lewis M.; Weller, Mark T. Structural diversity in hybrid organic‒inorganic lead iodide materials Acta Crystallographica Section B, 2015, 71, 668-678 |
2107274 | CIF HKL Paper | Bi23 O46.5 W4 | F -4 3 m | 16.633; 16.633; 16.633 90; 90; 90 | 4601.63 | Wind, Julia; Auckett, Josie E.; Withers, Ray L.; Piltz, Ross O.; Maljuk, Andrey; Ling, Chris D. Type II Bi~1{-~<i>x</i>}W<i>~x~</i>O~1.5+1.5<i>x~</i>: a (3+3)-dimensional commensurate modulation that stabilizes the fast-ion conducting delta phase of bismuth oxide Acta Crystallographica Section B, 2015, 71, 679-687 |
2107275 | CIF HKL Paper | C24 H16 N4 | P 1 21/n 1 | 23.9426; 10.4477; 14.9833 90; 106.145; 90 | 3600.18 | Granifo, Juan; Westermeyer, Marleen; Riquelme, Maricel; Gaviño, Rubén; Suárez, Sebastián; Halac, Emilia B.; Baggio, Ricardo A temperature-induced order‒disorder phase transition in a 4-substituted 4,2':6',4''-terpyridine Acta Crystallographica Section B, 2015, 71, 805-813 |
2107276 | CIF HKL Paper | C24 H16 N4 | P 1 21/n 1 | 24.0305; 10.4656; 15.0315 90; 106.303; 90 | 3628.32 | Granifo, Juan; Westermeyer, Marleen; Riquelme, Maricel; Gaviño, Rubén; Suárez, Sebastián; Halac, Emilia B.; Baggio, Ricardo A temperature-induced order‒disorder phase transition in a 4-substituted 4,2':6',4''-terpyridine Acta Crystallographica Section B, 2015, 71, 805-813 |
2107277 | CIF HKL Paper | C24 H16 N4 | P 1 21/n 1 | 24.2412; 10.4907; 15.0278 90; 106.656; 90 | 3661.3 | Granifo, Juan; Westermeyer, Marleen; Riquelme, Maricel; Gaviño, Rubén; Suárez, Sebastián; Halac, Emilia B.; Baggio, Ricardo A temperature-induced order‒disorder phase transition in a 4-substituted 4,2':6',4''-terpyridine Acta Crystallographica Section B, 2015, 71, 805-813 |
2107278 | CIF HKL Paper | C24 H16 N4 | P 1 21/c 1 | 12.2957; 10.5239; 14.925 90; 107.508; 90 | 1841.81 | Granifo, Juan; Westermeyer, Marleen; Riquelme, Maricel; Gaviño, Rubén; Suárez, Sebastián; Halac, Emilia B.; Baggio, Ricardo A temperature-induced order‒disorder phase transition in a 4-substituted 4,2':6',4''-terpyridine Acta Crystallographica Section B, 2015, 71, 805-813 |
2107279 | CIF HKL Paper | C24 H16 N4 | P 1 21/c 1 | 12.3277; 10.5211; 14.9441 90; 107.638; 90 | 1847.15 | Granifo, Juan; Westermeyer, Marleen; Riquelme, Maricel; Gaviño, Rubén; Suárez, Sebastián; Halac, Emilia B.; Baggio, Ricardo A temperature-induced order‒disorder phase transition in a 4-substituted 4,2':6',4''-terpyridine Acta Crystallographica Section B, 2015, 71, 805-813 |
2107280 | CIF Paper | Br K O3 | R 3 m :H | 6.0104; 6.0104; 8.162 90; 90; 120 | 255.35 | Santamaría-Pérez, David; Chulia-Jordan, Raquel; Rodríguez-Hernández, Placida; Muñoz, Alfonso Crystal behavior of potassium bromate under compression Acta Crystallographica Section B, 2015, 71, 798-804 |
2107281 | CIF HKL Paper | C30 H54 B Br F4 N2 O2 P2 Ru | P -1 | 10.7965; 12.2449; 13.7452 104.778; 91.462; 108.35 | 1656.57 | Casaretto, Nicolas; Pillet, Sébastien; Bendeif, El-Eulmi; Schaniel, Dominik; Gallien, Anna K. E.; Klüfers, Peter; Woike, Theo Photocrystallography and IR spectroscopy of light-induced linkage NO isomers in [RuBr(NO)~2~(PCyp~3~)~2~]BF~4~ Acta Crystallographica Section B, 2015, 71, 788-797 |
2107282 | CIF HKL | C30 H54 B Br F4 N2 O2 P2 Ru | P -1 | 10.7862; 12.2712; 13.7402 104.562; 91.987; 108.301 | 1658.37 | Casaretto, Nicolas; Pillet, Sébastien; Bendeif, El-Eulmi; Schaniel, Dominik; Gallien, Anna K. E.; Klüfers, Peter; Woike, Theo Photocrystallography and IR spectroscopy of light-induced linkage NO isomers in [RuBr(NO)~2~(PCyp~3~)~2~]BF~4~ Acta Crystallographica Section B, 2015, 71, 788-797 |
2107283 | CIF Paper | Mn2 Si3.5 | I 41/a m d :2 | 5.5235; 5.5235; 4.3634 90; 90; 90 | 133.123 | Akselrud, L.; Cardoso Gil, R.; Wagner-Reetz, M.; Grin, Yu. Disorder in the composite crystal structure of the manganese `disilicide' MnSi~1.73~ from powder X-ray diffraction data Acta Crystallographica Section B, 2015, 71, 707-712 |
2107284 | CIF HKL | Li10.35 P1.65 S12 Si1.35 | P 42/n m c :1 | 8.6439; 8.6439; 12.50773 90; 90; 90 | 934.54 | Hori, Satoshi; Taminato, Sou; Suzuki, Kota; Hirayama, Masaaki; Kato, Yuki; Kanno, Ryoji Structure‒property relationships in lithium superionic conductors having a Li~10~GeP~2~S~12~-type structure Acta Crystallographica Section B, 2015, 71, 727-736 |
2107285 | CIF HKL | Li10.35 P1.65 S12 Si1.35 | P 42/n m c :1 | 8.68385; 8.68385; 12.55589 90; 90; 90 | 946.83 | Hori, Satoshi; Taminato, Sou; Suzuki, Kota; Hirayama, Masaaki; Kato, Yuki; Kanno, Ryoji Structure‒property relationships in lithium superionic conductors having a Li~10~GeP~2~S~12~-type structure Acta Crystallographica Section B, 2015, 71, 727-736 |
2107286 | CIF HKL | Li10.35 P1.65 S12 Si1.35 | P 42/n m c :1 | 8.76517; 8.76517; 12.67003 90; 90; 90 | 973.416 | Hori, Satoshi; Taminato, Sou; Suzuki, Kota; Hirayama, Masaaki; Kato, Yuki; Kanno, Ryoji Structure‒property relationships in lithium superionic conductors having a Li~10~GeP~2~S~12~-type structure Acta Crystallographica Section B, 2015, 71, 727-736 |
2107287 | CIF HKL | Li9.81 P2.19 S12 Sn0.81 | P 42/n m c :1 | 8.70054; 8.70054; 12.6861 90; 90; 90 | 960.33 | Hori, Satoshi; Taminato, Sou; Suzuki, Kota; Hirayama, Masaaki; Kato, Yuki; Kanno, Ryoji Structure‒property relationships in lithium superionic conductors having a Li~10~GeP~2~S~12~-type structure Acta Crystallographica Section B, 2015, 71, 727-736 |
2107288 | CIF HKL | Li9.81 P2.19 S12 Sn0.81 | P 42/n m c :1 | 8.73764; 8.73764; 12.7166 90; 90; 90 | 970.866 | Hori, Satoshi; Taminato, Sou; Suzuki, Kota; Hirayama, Masaaki; Kato, Yuki; Kanno, Ryoji Structure‒property relationships in lithium superionic conductors having a Li~10~GeP~2~S~12~-type structure Acta Crystallographica Section B, 2015, 71, 727-736 |
2107289 | CIF HKL | Li9.81 P2.19 S12 Sn0.81 | P 42/n m c :1 | 8.81049; 8.81049; 12.79398 90; 90; 90 | 993.129 | Hori, Satoshi; Taminato, Sou; Suzuki, Kota; Hirayama, Masaaki; Kato, Yuki; Kanno, Ryoji Structure‒property relationships in lithium superionic conductors having a Li~10~GeP~2~S~12~-type structure Acta Crystallographica Section B, 2015, 71, 727-736 |
2107290 | CIF HKL Paper | B2 V | P 6/m m m | 2.9977; 2.9977; 3.056 90; 90; 120 | 23.783 | Terlan, Bürgehan; Akselrud, Lev; Baranov, Alexey I.; Borrmann, Horst; Grin, Yuri On the transferability of electron density in binary vanadium borides VB, V~3~B~4~ and VB~2~ Acta Crystallographica Section B, 2015, 71, 777-787 |
2107291 | CIF HKL Paper | B V | C m c m | 3.0616; 8.0495; 2.9733 90; 90; 90 | 73.275 | Terlan, Bürgehan; Akselrud, Lev; Baranov, Alexey I.; Borrmann, Horst; Grin, Yuri On the transferability of electron density in binary vanadium borides VB, V~3~B~4~ and VB~2~ Acta Crystallographica Section B, 2015, 71, 777-787 |
2107292 | CIF HKL Paper | B4 V3 | I m m m | 2.9821; 3.0601; 13.2251 90; 90; 90 | 120.686 | Terlan, Bürgehan; Akselrud, Lev; Baranov, Alexey I.; Borrmann, Horst; Grin, Yuri On the transferability of electron density in binary vanadium borides VB, V~3~B~4~ and VB~2~ Acta Crystallographica Section B, 2015, 71, 777-787 |
2107293 | CIF HKL Paper | Cs F7 Y2 | P n n a | 13.6028; 12.3072; 7.8426 90; 90; 90 | 1312.9 | McMillen, Colin D.; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D.; Kolis, Joseph W. Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides Acta Crystallographica Section B, 2015, 71, 768-776 |
2107294 | CIF HKL | F7 Rb Sm2 | P n n a | 13.9359; 12.2412; 7.9329 90; 90; 90 | 1353.3 | McMillen, Colin D.; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D.; Kolis, Joseph W. Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides Acta Crystallographica Section B, 2015, 71, 768-776 |
2107295 | CIF HKL | Cs F7 Gd2 | P n n a | 13.828; 12.415; 7.9681 90; 90; 90 | 1367.9 | McMillen, Colin D.; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D.; Kolis, Joseph W. Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides Acta Crystallographica Section B, 2015, 71, 768-776 |
2107296 | CIF HKL | F10 K Y3 | F m -3 m | 11.5439; 11.5439; 11.5439 90; 90; 90 | 1538.4 | McMillen, Colin D.; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D.; Kolis, Joseph W. Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides Acta Crystallographica Section B, 2015, 71, 768-776 |
2107297 | CIF HKL | F10 Rb Y3 | P 63 m c | 8.1976; 8.1976; 13.384 90; 90; 120 | 778.9 | McMillen, Colin D.; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D.; Kolis, Joseph W. Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides Acta Crystallographica Section B, 2015, 71, 768-776 |
2107298 | CIF HKL | F10 Rb Sm3 | F m -3 m | 11.8576; 11.8576; 11.8576 90; 90; 90 | 1667.2 | McMillen, Colin D.; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D.; Kolis, Joseph W. Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides Acta Crystallographica Section B, 2015, 71, 768-776 |
2107299 | CIF HKL | F10 Gd3 Rb | P 63 m c | 8.354; 8.354; 13.649 90; 90; 120 | 824.9 | McMillen, Colin D.; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D.; Kolis, Joseph W. Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides Acta Crystallographica Section B, 2015, 71, 768-776 |
2107300 | CIF HKL | F10 K Lu3 | P 63 m c | 8.042; 8.042; 13.154 90; 90; 120 | 736.7 | McMillen, Colin D.; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D.; Kolis, Joseph W. Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides Acta Crystallographica Section B, 2015, 71, 768-776 |
2107301 | CIF | Al2.144 O3.2 | F d -3 m :2 | 7.914; 7.914; 7.914 90; 90; 90 | 495.665 | Zhou, R.-S.; Snyder, R.L. Structures and transformation mechanisms of the eta, gamma and theta transition aluminas Acta Crystallographica B (39,1983-), 1991, 47, 617-630 |
2107302 | CIF | Al2.427 O3.64 | C 1 2/m 1 | 11.854; 2.904; 5.622 90; 103.83; 90 | 187.921 | Zhou, R.-S.; Snyder, R.L. Structures and transformation mechanisms of the eta, gamma and theta transition aluminas Acta Crystallographica B (39,1983-), 1991, 47, 617-630 |
2107303 | CIF | Ce S2 | P n a 21 | 8.103; 4.093; 16.221 90; 90; 90 | 537.979 | Yanagisawa, Y.; Kume, S.; Kanamaru, F. Structure of orthorhombic Ce S2 prepared at 1773 K and 5.5 GPa Acta Crystallographica B (24,1968-38,1982), 1979, 35, 137-139 |
2107304 | CIF | Cl4 Co K2 | P n a 21 | 26.838; 12.406; 7.262 90; 90; 90 | 2417.9 | Vermin, W.J.; Verschoor, G.C.; Ijdo, D.J.W. Two modifications of cobalt dipotassium tetrachloride Acta Crystallographica B (24,1968-38,1982), 1976, 32, 3325-3328 |
2107305 | CIF | Cl4 Co K2 | P 1 21/c 1 | 6.801; 9.569; 12.757 90; 107; 90 | 793.934 | Vermin, W.J.; Ijdo, D.J.W.; Verschoor, G.C. Two modifications of cobalt dipotassium tetrachloride Acta Crystallographica B (24,1968-38,1982), 1976, 32, 3325-3328 |
2107306 | CIF | Bi3 Y5 | P n m a | 8.1895; 9.4202; 11.9753 90; 90; 90 | 923.855 | Wang, Y.; Calvert, L.D.; Gabe, E.J.; Taylor, J.B. Crystal structure of Y5 Bi3 and its relation to the Yb5 Sb3 type structures Acta Crystallographica B (24,1968-38,1982), 1976, 32, 1440-1445 |
2107307 | CIF | As4 Eu5 | C m c e | 15.802; 8.021; 8.058 90; 90; 90 | 1021.33 | Wang, Y.; Gabe, E.J.; Taylor, J.B.; Calvert, L.D. Structure of europium arsenide Eu5 As4: A more symmetrical version of the Sm5 Ge4-type structure Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1962-1965 |
2107308 | CIF | As Ta3 | C 1 2/c 1 | 14.6773; 5.0954; 14.5505 90; 90.57; 90 | 1088.13 | Wang, Y.; Calvert, L.D.; Taylor, J.B.; Gabe, E.J. Structures of Ta3 As and (Nb,Ta)3 As Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1447-1450 |
2107309 | CIF | Cl4 Ga2 | P n n a | 7.2235; 9.7211; 9.5421 90; 90; 90 | 670.05 | Wilkinson, A.P.; Cheetham, A.K.; Cox, D.E. Study of oxidation-state contrast in gallium dichloride by synchrotron x-ray anomalous scattering Acta Crystallographica B (39,1983-), 1991, 47, 155-161 |
2107310 | CIF | C16 H20 O48 Si24 | P 21 21 21 | 20.121; 19.82; 13.438 90; 90; 90 | 5359.05 | van Koningsveld, H.; Jansen, J.C.; van Bekkum, H.; Tuinstra, F. The location of p-xylene in a single crystal of zeolite H-ZSM 5 with a new , sorbate-induced, orthorhombic framework symmetry Acta Crystallographica B (39,1983-), 1989, 45, 423-431 |
2107311 | CIF | O12 Pr7 | R -3 :H | 10.278; 10.278; 9.6069 90; 90; 120 | 878.883 | von Dreele, R.B.; Eyring, L.; Bowman, A.L.; Yarnell, J.L. Refinement of the crystal structure of Pr7 O12 by powder neutron diffraction Acta Crystallographica B (24,1968-38,1982), 1975, 31, 971-974 |
2107312 | CIF | O3 W | P n m a | 7.57; 7.341; 7.754 90; 90; 90 | 430.9 | Salje, E. The orthorhombic phase of W O3 Acta Crystallographica B (24,1968-38,1982), 1977, 33, 574-577 |
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 |
2107314 | CIF | Al96 Ca47.04 H217.28 O492.64 Si96 | F d -3 :2 | 25.06; 25.06; 25.06 90; 90; 90 | 15737.8 | Smolin, Yu.I.; Shepelev, Yu.F.; Anderson, A.A. Atomic scale mechanism of CaX zeolite dehydration Acta Crystallographica B (39,1983-), 1989, 45, 124-128 |
2107315 | CIF | Al92 Ca40.32 H64 O416 Si100 | F d -3 :2 | 25.06; 25.06; 25.06 90; 90; 90 | 15737.8 | Smolin, Yu.I.; Shepelev, Yu.F.; Anderson, A.A. Atomic scale mechanism of CaX zeolite dehydration Acta Crystallographica B (39,1983-), 1989, 45, 124-128 |
2107316 | CIF | Al96 Ca46.1 H21.8 O394.9 Si96 | F d -3 :2 | 25.06; 25.06; 25.06 90; 90; 90 | 15737.8 | Smolin, Yu.I.; Shepelev, Yu.F.; Anderson, A.A. Atomic scale mechanism of CaX zeolite dehydration Acta Crystallographica B (39,1983-), 1989, 45, 124-128 |
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