Crystallography Open Database
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Searching journal of publication like 'Acta Crystallogr.,Sect.B:Struct.Crystallogr.Cryst.Chem.'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1008168 | CIF | Ag2 H O4 P | P 31 1 2 | 6.19; 6.19; 9.015 90; 90; 120 | 299.1 | Tordjman, I; Boudjada, A; Guitel, J C; Masse, R Structure de l'Hydrogenophosphate D'Argent Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3723-3725 |
| 1008183 | CIF | Ag As2 Cu H3 O8 | P 1 21/a 1 | 9.716; 7.704; 9.209 90; 103.73; 90 | 669.6 | Boudjada, A; Masse, R; Guitel, J C Structure Cristalline d'un Orthoarseniate Acide Mixte de Cuivre(II)- Argent: Cu Ag H~3~ (As O~4~)~2~ Acta Crystallographica B (24,1968-38,1982), 1982, 38, 710-713 |
| 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 |
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