Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9011250 | CIF | F7 Ho2 K | C 1 2/m 1 | 14.287; 8.004; 11.95 90; 125.33; 90 | 1114.85 | Marsh, R. E.; Herbstein, F. H. More space-group changes Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88 |
| 9011251 | CIF | C16 H25 N O | C 1 2/c 1 | 24.28; 8.76; 14.03 90; 108; 90 | 2838.03 | Marsh, R. E.; Herbstein, F. H. More space-group changes Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88 |
| 9011252 | CIF | As3 Cd2 I | C 1 2/c 1 | 8.436; 9.594; 7.952 90; 100.65; 90 | 632.509 | Marsh, R. E.; Herbstein, F. H. More space-group changes Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88 |
| 9011253 | CIF | C2 Br2 O Tl | C m c m | 10.31; 8.56; 15.55 90; 90; 90 | 1372.34 | Marsh, R. E.; Herbstein, F. H. More space-group changes Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88 |
| 9011254 | CIF | C12 Cl3 Cr2 F2 N8 O14 | P -1 | 10.71; 9.047; 8.785 111.25; 100.44; 86.6 | 780.18 | Marsh, R. E.; Herbstein, F. H. More space-group changes Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88 |
| 9011255 | CIF | C6 H13 I S | P n a m | 18.038; 6.611; 7.42 90; 90; 90 | 884.829 | Marsh, R. E.; Herbstein, F. H. More space-group changes Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88 |
| 9011256 | CIF | C24 H2 N2 O5 | C 1 2/c 1 | 18.943; 11.318; 24.376 90; 94.5; 90 | 5210.03 | Marsh, R. E.; Herbstein, F. H. More space-group changes Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88 |
| 9011257 | CIF | Er2 F7 K | P n a m | 11.82; 13.333; 7.816 90; 90; 90 | 1231.77 | Marsh, R. E.; Herbstein, F. H. More space-group changes Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88 |
| 9011258 | CIF | Ag0.1 Au0.9 Te2 | C 1 2/m 1 | 7.1947; 4.4146; 5.0703 90; 90.038; 90 | 161.041 | Schutte, W. J.; de Boer, J. L. Valence fluctuations in the incommensurately modulated structure of calaverite AuTe2 Locality: Cripple Creek, Colorado Sample: T = 298 K Acta Crystallographica, Section B, 1988, 44, 486-494 |
| 9011259 | CIF | Ag0.1 Au0.9 Te2 | C 1 2/m 1 | 7.182; 4.402; 5.056 90; 89.99; 90 | 159.846 | Schutte, W. J.; de Boer, J. L. Valence fluctuations in the incommensurately modulated structure of calaverite AuTe2 Locality: Cripple Creek, Colorado Sample: T = 100 K Acta Crystallographica, Section B, 1988, 44, 486-494 |
| 9011260 | CIF | Mg2 O4 Ti | P 41 2 2 | 5.9748; 5.9748; 8.414 90; 90; 90 | 300.365 | Wechsler, B. A.; Von Dreele, R. B. Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 773 K Acta Crystallographica, Section B, 1989, 45, 542-549 |
| 9011261 | CIF | Mg O3 Ti | R -3 :H | 5.05478; 5.05478; 13.8992 90; 90; 120 | 307.557 | Wechsler, B. A.; Von Dreele, R. B. Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Acta Crystallographica, Section B, 1989, 45, 542-549 |
| 9011262 | CIF | Mg0.999 O5 Ti2.001 | B b m m | 9.7289; 10.0057; 3.7416 90; 90; 90 | 364.224 | Wechsler, B. A.; Von Dreele, R. B. Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 973 K Acta Crystallographica, Section B, 1989, 45, 542-549 |
| 9011263 | CIF | Mg O5 Ti2 | B b m m | 9.7492; 9.9896; 3.746 90; 90; 90 | 364.825 | Wechsler, B. A.; Von Dreele, R. B. Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 1773 Acta Crystallographica, Section B, 1989, 45, 542-549 |
| 9011264 | CIF | D12 Ni O10 S | P 43 21 2 | 6.7803; 6.7803; 18.288 90; 90; 90 | 840.744 | McIntyre, G. J.; Ptasiewicz-Bak H; Olovsson, I. Bonding deformation and superposition effects in the electron density of tetragonal nickel sulfate hexadeuterate NiSO4*6D2O Sample: neutron refinement Note: anisoU's from ICSD Acta Crystallographica, Section B, 1990, 46, 27-39 |
| 9011265 | CIF | H12 Ni O10 S | P 43 21 2 | 6.7803; 6.7803; 18.288 90; 90; 90 | 840.744 | McIntyre, G. J.; Ptasiewicz-Bak H; Olovsson, I. Bonding deformation and superposition effects in the electron density of tetragonal nickel sulfate hexadeuterate NiSO4*6D2O Sample: X-ray refinement Acta Crystallographica, Section B, 1990, 46, 27-39 |
| 9011266 | CIF | Ca4 H120 Na3 O252 Si85 | P n m a | 20.078; 19.894; 13.372 90; 90; 90 | 5341.2 | van Koningsveld, H. High-temperature (350 K) orthorhombic framework structure of zeolite H-ZSM-5 Note: anisotropic thermal parameters obtained from ICSD Acta Crystallographica, Section B, 1990, 46, 731-735 |
| 9011267 | CIF | C14 H10 | P 1 21 1 | 8.441; 6.14; 9.438 90; 97.96; 90 | 484.437 | Petricek, V.; Cisarova, I.; Hummel, L.; Kroupa, J.; Brezina, B. Oriental disorder in phenanthrene. Structure determination at 248, 295, 339 and 344 K Locality: synthetic Acta Crystallographica, Section B, 1990, 46, 830-832 |
| 9011268 | CIF | Bi12.5 Fe0.5 O19.48 | I 2 3 | 10.184; 10.184; 10.184 90; 90; 90 | 1056.22 | Radaev, S. F.; Muradyan, L. A.; Simonov, V. I. Atomic structure and crystal chemistry of sillenites: Bi12(Bi3+0.50Fe3+0.50)O19.50 and Bi12(Bi3+0.50Fe3+0.50)O19.33 Note: anisoB's from ICSD Acta Crystallographica, Section B, 1991, 47, 1-6 |
| 9011269 | CIF | Bi12.672 O19.32 Zn0.33 | I 2 3 | 10.207; 10.207; 10.207 90; 90; 90 | 1063.39 | Radaev, S. F.; Muradyan, L. A.; Simonov, V. I. Atomic structure and crystal chemistry of sillenites: Bi12(Bi3+0.50Fe3+0.50)O19.50 and Bi12(Bi3+0.50Fe3+0.50)O19.33 Note: anisoB's from ICSD Note: z(Bi) corrected Acta Crystallographica, Section B, 1991, 47, 1-6 |
| 9011270 | CIF | Al11 Na1.221 O17.111 | P 63/m m c | 5.5929; 5.5929; 22.526 90; 90; 120 | 610.223 | Edstrom, K.; Thomas, J. O.; Farrington, G. C. Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Locality: synthetic Sample: y = 0 Note: anisoB's from ICSD Acta Crystallographica, Section B, 1991, 47, 635-643 |
| 9011271 | CIF | Al11 Cd0.105 Na1.008 O17.111 | P 63/m m c | 5.5921; 5.5921; 22.526 90; 90; 120 | 610.049 | Edstrom, K.; Thomas, J. O.; Farrington, G. C. Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Locality: synthetic Sample: y = .21 Note: anisoB's from ICSD Acta Crystallographica, Section B, 1991, 47, 635-643 |
| 9011272 | CIF | Al11 Cd0.222 Na0.774 O17.111 | P 63/m m c | 5.5906; 5.5906; 22.519 90; 90; 120 | 609.532 | Edstrom, K.; Thomas, J. O.; Farrington, G. C. Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Locality: synthetic Note: anisoB's from ICSD Sample: y = .45 Acta Crystallographica, Section B, 1991, 47, 635-643 |
| 9011273 | CIF | Al11 Cd0.615 O17.111 | P 63/m m c | 5.5869; 5.5869; 22.37 90; 90; 120 | 604.698 | Edstrom, K.; Thomas, J. O.; Farrington, G. C. Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Note: anisoB's from ICSD Sample: y = 1.22 Acta Crystallographica, Section B, 1991, 47, 635-643 |
| 9011274 | CIF | K O5 P Ti | P n a 21 | 12.8209; 6.4052; 10.5932 90; 90; 90 | 869.918 | Hansen, N. K.; Protas, J.; Marnier, G. The electron-density distribution in KTiOPO4 Acta Crystallographica, Section B, 1991, 47, 660-672 |
| 9011275 | CIF | Ag Cu S | C m c 21 | 4.059; 6.617; 7.967 90; 90; 90 | 213.981 | Baker, C. L.; Lincoln, F. J.; Johnson, A. W. S. A low-temperature structural phase transformation in CuAgS Sample: T = 298 K Acta Crystallographica, Section B, 1991, 47, 891-899 |
| 9011276 | CIF | Ag Cu S | P m c 21 | 4.047; 6.592; 7.93 90; 90; 90 | 211.555 | Baker, C. L.; Lincoln, F. J.; Johnson, A. W. S. A low-temperature structural phase transformation in CuAgS Sample: T = 120 K Note: dimorphic with stromeyerite Acta Crystallographica, Section B, 1991, 47, 891-899 |
| 9011277 | CIF | Ag Cu S | P m c 21 | 4.0431; 6.591; 7.9149 90; 90; 90 | 210.917 | Baker, C. L.; Lincoln, F. J.; Johnson, A. W. S. A low-temperature structural phase transformation in CuAgS Sample: T = 13 K Note: dimorphic with stromeyerite Acta Crystallographica, Section B, 1991, 47, 891-899 |
| 9011278 | CIF | Au Te2 | C 1 2/m 1 | 7.189; 4.407; 5.069 90; 89.96; 90 | 160.596 | Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L. High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 0.0001 GPa Acta Crystallographica, Section B, 1993, 49, 6-11 |
| 9011279 | CIF | Au Te2 | C 1 2/m 1 | 7.189; 4.407; 5.069 90; 89.96; 90 | 160.596 | Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L. High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = <0.5 GPa Acta Crystallographica, Section B, 1993, 49, 6-11 |
| 9011280 | CIF | Au Te2 | C 1 2/m 1 | 7.171; 4.385; 5.064 90; 90.04; 90 | 159.237 | Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L. High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 0.41 GPa Acta Crystallographica, Section B, 1993, 49, 6-11 |
| 9011281 | CIF | Au Te2 | C 1 2/m 1 | 7.164; 4.371; 5.064 90; 90; 90 | 158.573 | Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L. High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 0.63 GPa Acta Crystallographica, Section B, 1993, 49, 6-11 |
| 9011282 | CIF | Au Te2 | C 1 2/m 1 | 7.129; 4.314; 5.036 90; 90.15; 90 | 154.879 | Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L. High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 1.63 GPa Acta Crystallographica, Section B, 1993, 49, 6-11 |
| 9011283 | CIF | Au Te2 | C 1 2/m 1 | 7.11; 4.29; 5.05 90; 90.3; 90 | 154.032 | Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L. High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 1.78 GPa Acta Crystallographica, Section B, 1993, 49, 6-11 |
| 9011284 | CIF | Au Te2 | C 1 2/m 1 | 7.1; 4.286; 5.029 90; 90.3; 90 | 153.033 | Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L. High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 1.89 GPa Acta Crystallographica, Section B, 1993, 49, 6-11 |
| 9011285 | CIF | Au Te2 | C 1 2/m 1 | 7.1; 4.221; 5.029 90; 90.4; 90 | 150.711 | Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L. High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 2.40 GPa Acta Crystallographica, Section B, 1993, 49, 6-11 |
| 9011286 | CIF | Au Te2 | P -3 m 1 | 4.1; 4.1; 5.021 90; 90; 120 | 73.095 | Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L. High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 3.72 GPa Acta Crystallographica, Section B, 1993, 49, 6-11 |
| 9011287 | CIF | Au Te2 | P -3 m 1 | 4.078; 4.078; 5 90; 90; 120 | 72.01 | Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L. High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 5.13 GPa Acta Crystallographica, Section B, 1993, 49, 6-11 |
| 9011288 | CIF | H12 Ni O10 S | P 43 21 2 | 6.7778; 6.7778; 18.176 90; 90; 90 | 834.979 | Ptasiewicz-Bak H; Olovsson, I.; McIntyre, G. J. Bonding deformation and superposition in the electron density of tetragonal NiSO4*6H2O at 25K Sample: T = 25 K, neutron refinement Note: anisoU's from ICSD Acta Crystallographica, Section B, 1993, 49, 192-201 |
| 9011289 | CIF | Ni O10 S | P 43 21 2 | 6.7778; 6.7778; 18.176 90; 90; 90 | 834.979 | Ptasiewicz-Bak H; Olovsson, I.; McIntyre, G. J. Bonding deformation and superposition in the electron density of tetragonal NiSO4*6H2O at 25K Sample: T = 25 K, X-ray refinement Acta Crystallographica, Section B, 1993, 49, 192-201 |
| 9011290 | CIF | F6 K2 Si | F m -3 m | 8.1419; 8.1419; 8.1419 90; 90; 90 | 539.731 | Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y. Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6 Sample: .9 angstroms Acta Crystallographica, Section B, 1993, 49, 967-973 |
| 9011291 | CIF | F6 K2 Si | F m -3 m | 8.1419; 8.1419; 8.1419 90; 90; 90 | 539.731 | Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y. Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6 Sample: .7 angstroms Acta Crystallographica, Section B, 1993, 49, 967-973 |
| 9011292 | CIF | F6 K2 Si | F m -3 m | 8.1419; 8.1419; 8.1419 90; 90; 90 | 539.731 | Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y. Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6 Sample: Mo K-alpha Acta Crystallographica, Section B, 1993, 49, 967-973 |
| 9011293 | CIF | Cl6 K2 Pd | F m -3 m | 8.1419; 8.1419; 8.1419 90; 90; 90 | 539.731 | Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y. Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6 Acta Crystallographica, Section B, 1993, 49, 967-973 |
| 9011296 | CIF | Fe4 H2 K2 Mg2 Na2 O15 Si4 Ti | P 1 | 10.37; 23.129; 5.322 90; 99.55; 90 | 1258.78 | Shi, N.; Ma, Z.; Li, G.; Yamnova, M. A.; Pushcharovsky, D. Y. Structure refinement of monoclinic astrophyllite Locality: Khibina alkaline massif, Russia Acta Crystallographica, Section B, 1998, 54, 109-114 |
| 9011298 | CIF | H34 O40 U8 | P b c n | 14.6861; 13.9799; 16.7063 90; 90; 90 | 3429.97 | Weller, M. T.; Light, M. E.; Gelbrich, T. Structure of uranium (VI) oxide dihydrate UO3*2H2O; synthetic meta-schoepite (UO2)4O(OH)6*5H2O Sample: T = 150 K Acta Crystallographica, Section B, 2000, 56, 577-583 |
| 9011299 | CIF | Al3 H21.52 N2.38 Na0.26 O20.64 Si5 | P 1 21/m 1 | 10.0507; 14.2016; 8.7281 90; 125.123; 90 | 1018.97 | Gualtieri, A. F. Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 1 Acta Crystallographica, Section B, 2000, 56, 584-593 |
| 9011300 | CIF | Al2.2 H20.08 N2.02 Na0.2 O20.74 Si5.8 | P 1 21/m 1 | 10.0122; 14.1943; 8.7284 90; 125.024; 90 | 1015.82 | Gualtieri, A. F. Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 2 Acta Crystallographica, Section B, 2000, 56, 584-593 |
| 9011301 | CIF | Al1.9 H18.8 N1.7 Na0.2 O21.18 Si6.1 | P 1 21/m 1 | 9.9596; 14.2015; 8.7051 90; 124.99; 90 | 1008.71 | Gualtieri, A. F. Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 3 Acta Crystallographica, Section B, 2000, 56, 584-593 |
| 9011304 | CIF | C Na2 O3 | C 1 2/m 1 | 8.92; 5.245; 6.05 90; 101.35; 90 | 277.516 | Dusek, M.; Chapuis, G.; Meyer, M.; Petricek, V. Sodium carbonate revisited Sample: Gamma phase, T = 295 K Acta Crystallographica, Section B, 2003, 59, 337-352 |
| 9011305 | CIF | C Na2 O3 | C 1 2/m 1 | 8.898; 5.237; 5.996 90; 101.87; 90 | 273.432 | Dusek, M.; Chapuis, G.; Meyer, M.; Petricek, V. Sodium carbonate revisited Sample: Delta phase, T = 110 K Acta Crystallographica, Section B, 2003, 59, 337-352 |
| 9011308 | CIF | Ag12.226 As1.192 Cu3.772 S11 Sb0.808 | P -3 m 1 | 7.389; 7.389; 11.816 90; 90; 120 | 558.692 | Bindi, L.; Evain, M.; Menchetti, S. Temperature dependence of the silver distribution in the crystal structure of natural pearcite, (Ag,Cu)16(As,Sb)2S11 Sample: T = 15 K Acta Crystallographica, Section B, 2006, 62, 212-219 |
| 9011309 | CIF | Ag13.646 As1.179 Cu2.966 S11 Sb0.821 | P -3 m 1 | 7.3721; 7.3721; 11.8104 90; 90; 120 | 555.876 | Bindi, L.; Evain, M.; Menchetti, S. Temperature dependence of the silver distribution in the crystal structure of natural pearcite, (Ag,Cu)16(As,Sb)2S11 Sample: T = 120 K Acta Crystallographica, Section B, 2006, 62, 212-219 |
| 9011310 | CIF | Ag13.032 As1.18 Cu2.968 S11 Sb0.82 | P -3 m 1 | 7.3876; 7.3876; 11.8882 90; 90; 120 | 561.893 | Bindi, L.; Evain, M.; Menchetti, S. Temperature dependence of the silver distribution in the crystal structure of natural pearcite, (Ag,Cu)16(As,Sb)2S11 Sample: T = 300 K Acta Crystallographica, Section B, 2006, 62, 212-219 |
| 9011311 | CIF | Na O3.5 Si1.5 | C 1 2/c 1 | 20.416; 6.4987; 4.9294 90; 90.26; 90 | 654.014 | Kruger, H.; Kahlenberg, V.; Friese, K. Na2Si3O7: an incommensurate structure with crenel-type modulation functions, refined from a twinned crystal Acta Crystallographica, Section B, 2006, 62, 440-446 |
| 9011312 | CIF | Ag29.629 Cu2.371 S22 Sb4 | C 1 2/c 1 | 26.188; 15.1199; 23.784 90; 90; 90 | 9417.51 | Evain, M.; Bindi, L.; Menchetti, S. Structural compexity in minerals: twinning, polytypism and disorder in the crystal structure of polybasite, (Ag,Cu)16(Sb,As)2S11 Sample: T = 100 K Sample: polytype 222 Acta Crystallographica, Section B, 2006, 62, 447-456 |
| 9011313 | CIF | Ag29.04 Cu2.96 S22 Sb4 | P 3 2 1 | 15.0954; 15.0954; 11.8825 90; 90; 120 | 2344.92 | Evain, M.; Bindi, L.; Menchetti, S. Structural compexity in minerals: twinning, polytypism and disorder in the crystal structure of polybasite, (Ag,Cu)16(Sb,As)2S11 Sample: T = 120 K Sample: polytype 221 Acta Crystallographica, Section B, 2006, 62, 447-456 |
| 9011314 | CIF | H2 Ni O2 | P -3 m 1 | 3.12; 3.12; 4.61 90; 90; 120 | 38.863 | Ramesh, T. N.; Kamath, P. V.; Shivakumara, C. Classification of stacking faults and their stepwise elemination during the disorder -> order transformation of nickel hydroxide Acta Crystallographica, Section B, 2006, 62, 530-536 |
| 9011315 | CIF | Ca2 Co0.9 O7 Si2 Zn0.1 | P -4 | 23.518; 23.518; 5.0263 90; 90; 90 | 2780.03 | Jia, Z. H.; Schaper, A. K.; Massa, W.; Treutmann, W.; Rager, H. Structure and phase transitions in Ca2CoSi2O7-Ca2ZnSi2O7 solid-solution crystals Acta Crystallographica, Section B, 2006, 62, 547-555 |
| 9011317 | CIF Paper | Ag16.08 As0.34 Cu1.84 S8.34 Sb1.66 Se2.66 | P -3 m 1 | 7.595; 7.595; 12.0731 90; 90; 120 | 603.122 | Evain, M.; Bindi, L.; Menchetti, S. Structure and phase transition of the Se-rich variety of antimonpearceite, [(Ag,Cu)~6~(Sb,As)~2~(S,Se)~7~][Ag~9~Cu(S,Se)~2~Se~2~] Acta Crystallographica Section B, 2006, 62, 768-774 |
| 9011318 | CIF Paper | Ag14.691 Cu1.309 S8.37 Sb2 Se2.63 | P 1 21/c 1 | 13.1426; 7.5879; 23.729 90; 90; 90 | 2366.37 | Evain, M.; Bindi, L.; Menchetti, S. Structure and phase transition of the Se-rich variety of antimonpearceite, [(Ag,Cu)~6~(Sb,As)~2~(S,Se)~7~][Ag~9~Cu(S,Se)~2~Se~2~] Acta Crystallographica Section B, 2006, 62, 768-774 |
| 9011319 | CIF | Cu0.298 Pb0.95 S3.36 Sb0.408 Sn0.851 | C -1 | 3.6661; 6.3138; 11.9028 92.49; 90.59; 89.986 | 275.24 | Evain, M.; Petricek, V.; Moelo, Y.; Maurel, C. First (3+2)-dimensional superspace approach to the structure of levyclaudite-(Sb), a member of the cylindrite-type minerals Acta Crystallographica, Section B, 2006, 62, 775-789 |
| 9011321 | CIF | Cl2 Cu3 H6 Mg O6 | P -3 m 1 | 6.2733; 6.2733; 5.7472 90; 90; 120 | 195.875 | Malcherek, T.; Schluter, J. Cu3MgCl2(OH)6 and the bond-valence parameters of the OH-Cl bond Acta Crystallographica, Section B, 2007, 63, 157-160 |
| 9011322 | CIF | Cl H6 Mg0.5 O2 | C m c m | 4.21616; 11.023; 7.2951 90; 90; 90 | 339.038 | Sugimoto, K.; Dinnebier, R. E.; Hanson, J. C. Structures of three dehydration products of bischofite from in situ synchrotron powder diffraction data (MgCl2*nH2O; n = 1,2,4) Acta Crystallographica, Section B, 2007, 63, 235-242 |
| 9011338 | CIF | Al7 Ca6 O16.348 | I -4 3 d | 12.0449; 12.0449; 12.0449 90; 90; 90 | 1747.47 | Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A. Structure and oxygen mobility in mayenite (Ca12Al14O33): a high-temperature neutron powder diffraction study Sample: T = 1223 K Acta Crystallographica, Section B, 2007, 63, 675-682 |
| 9011340 | CIF | D6 H4 N O9 P U | P 4/n c c :2 | 7.0221; 7.0221; 18.0912 90; 90; 90 | 892.075 | Fitch, A. N.; Fender, B. E. F. The structure of deuterated ammomium uranyl phosphate trihydrate, ND4UO2PO4*3D2O by powder neutron diffraction Acta Crystallographica, Section C, 1983, 39, 162-166 |
| 9011341 | CIF | Ba0.14 Ca0.3 Cr3.1 Fe2.2 K0.62 Mg1.333 Na0.14 Nb0.233 O38 Sr0.1 Ti12.9 V0.233 Zr0.7 | R -3 :R | 9.119; 9.119; 9.119 69.24; 69.24; 69.24 | 639.924 | Gatehouse, B. M.; Grey, I. E.; Smyth, J. R. Structure refinement of mathiasite, (K0.62Na0.14Ba0.14Sr0.10) [Ti12.90Cr3.10Mg1.53Fe2.15Zr0.67Ca0.29V0.36]O38 locality: peridotite nodules, Bultfonten kimblerlite, South africa Acta Crystallographica, Section C, 1983, 39, 421-422 |
| 9011342 | CIF | Cu5 H10 O30 Pb2 Se6 U2 | P -1 | 11.955; 10.039; 5.639 89.78; 100.36; 91.34 | 665.556 | Ginderow, D.; Cesbron, F. Structure de la demesmaekerite,Pb2Cu5(SeO3)6(UO2)2(OH)6*2H2O Locality: Musoni, Kolwezi, Shaba, Zaire Note: anisoB's from ICSD Acta Crystallographica, Section C, 1983, 39, 824-827 |
| 9011343 | CIF | Ba N2 O6 | P a -3 | 8.1184; 8.1184; 8.1184 90; 90; 90 | 535.071 | Nowotny, H.; Heger, G. Structure refinement of strontium nitrate, Sr(NO3)2, and barium nitrate, Ba(NO3)2 Locality: synthetic Acta Crystallographica, Section C, 1983, 39, 952-956 |
| 9011344 | CIF | N2 O6 Sr | P a -3 | 7.7813; 7.7813; 7.7813 90; 90; 90 | 471.147 | Nowotny, H.; Heger, G. Structure refinement of strontium nitrate, Sr(NO3)2, and barium nitrate, Ba(NO3)2 Locality: synthetic Acta Crystallographica, Section C, 1983, 39, 952-956 |
| 9011345 | CIF | N2 | P 63/m m c | 3.595; 3.595; 5.845 90; 90; 120 | 65.42 | Schiferl, D.; Cromer, D. T.; Ryan, R. R.; Larson, A. C.; LeSar, R.; Mills, R. L. Structure of N2 at 2.94 GPa and 300 K Sample: at T = 300 K and P = 2.94 GPa Acta Crystallographica, Section C, 1983, 39, 1151-1153 |
| 9011346 | CIF | C8 H24 Ca Cu O14 | I 4/m | 11.152; 11.152; 16.24 90; 90; 90 | 2019.72 | Klop, E. A.; Duisenberg, A. J. M.; Spek, A. L. Reinvestigation of the structure of calcium copper acetate hexahydrate, CaCu(C2H3O2)4*6H2O Acta Crystallographica, Section C, 1983, 39, 1342-1344 |
| 9011347 | CIF | Ca Na O4 P | P n 21 a | 20.397; 5.412; 9.161 90; 90; 90 | 1011.27 | Ben Amara, M.; Vlasse, M.; Le Flem, G.; Hagenmuller, P. Structure of the low-temperature variety of calcium sodium orthophosphate, NaCaPO4 Locality: synthetic Acta Crystallographica, Section C, 1983, 39, 1483-1485 |
| 9011348 | CIF | Cu4 H6 O14 Se2 U | P n 21 m | 5.57; 19.088; 5.965 90; 90; 90 | 634.2 | Ginderow, D.; Cesbron, F. Structure da la derriksite, Cu4(UO2)(SeO3)2(OH)6 Note: anisoB's from ICSD Acta Crystallographica, Section C, 1983, 39, 1605-1607 |
| 9011349 | CIF | Cl O5.27 Sb4 | C 1 2/m 1 | 19.047; 4.053; 10.318 90; 110.25; 90 | 747.292 | Menchetti, S.; Sabelli, C.; Trosti-Ferroni R The structures of onoratoite, Sb8O11Cl2 and Sb8O11Cl2*6H2O Note: anisoB's from ICSD, corrected Acta Crystallographica, Section C, 1984, 40, 1506-1510 |
| 9011350 | CIF | Cl H9.04 O8.54 Sb4 | I m m m | 9.618; 13.148; 4.078 90; 90; 90 | 515.694 | Menchetti, S.; Sabelli, C.; Trosti-Ferroni R The structures of onoratoite, Sb8O11Cl2 and Sb8O11Cl2*6H2O Note: anisoB's from ICSD Acta Crystallographica, Section C, 1984, 40, 1506-1510 |
| 9011351 | CIF | Bi2 Mo O6 | P c a 21 | 5.4822; 16.1986; 5.5091 90; 90; 90 | 489.23 | Teller, R. G.; Brazdil, J. F.; Grasselli, R. K.; Jorgensen, J. D. The structure of gamma-bismuth molybdate, Bi2MoO6, by powder neutron diffraction Locality: synthetic Acta Crystallographica, Section C, 1984, 40, 2001-2005 |
| 9011352 | CIF | Cl2 H12 Mg O6 | C 1 2/m 1 | 9.8607; 7.1071; 6.0737 90; 93.758; 90 | 424.736 | Agron, P. A.; Busing, W. R. Magnesium dichloride hexahydrate, MgCl2*6H2O, by neutron diffraction Acta Crystallographica, Section C, 1985, 41, 8-10 |
| 9011353 | CIF | B2 Ca2 Fe0.9 H0.14 Mn0.03 O10 Si2 | P 1 21/a 1 | 9.786; 7.621; 4.776 90; 90.61; 90 | 356.17 | Miyawaki, R.; Nakai, I.; Nagashima, K. Structure of homilite, Ca2.00(Fe0.90Mn0.03)B2.00Si2.00O9.86(OH)0.14 Note: anisoB's form ICSD Acta Crystallographica, Section C, 1985, 41, 13-15 |
| 9011354 | CIF | C2 H10 Cu2 O20 U3 | P -1 | 7.767; 6.924; 7.85 92.16; 90.89; 93.48 | 421.018 | Ginderow, D.; Cesbron, F. Structure de la roubaultite, Cu2(UO2)3(CO3)2O2(OH)2(H2O)4 Note: anisoB's from ICSD Acta Crystallographica, Section C, 1985, 41, 654-657 |
| 9011355 | CIF | Al2.97 Ca0.8 Mg0.36 Na3.12 O15.12 S Si3.03 | P -4 3 n | 9.105; 9.105; 9.105 90; 90; 90 | 754.814 | Hassan, I.; Peterson, R. C.; Grundy, H. D. The structure of lazurite, ideally Na6Ca2(Al6Si6O24)S2, a member of the sodalite group Acta Crystallographica, Section C, 1985, 41, 827-832 |
| 9011356 | CIF | Al2.91 Ca0.6 Na3.48 O11.52 S Si3.09 | P -4 3 n | 9.054; 9.054; 9.054 90; 90; 90 | 742.201 | Hassan, I.; Peterson, R. C.; Grundy, H. D. The structure of lazurite, ideally Na6Ca2(Al6Si6O24)S2, a member of the sodalite group Acta Crystallographica, Section C, 1985, 41, 827-832 |
| 9011357 | CIF | Pb Te | F m -3 m | 6.4384; 6.4384; 6.4384 90; 90; 90 | 266.891 | Noda, Y.; Masumoto, K.; Ohba, S.; Saito, Y.; Toriumi, K.; Iwata, Y.; Shibuya, I. Temperature dependence of atomic thermal parameters of lead chalcogenides, PbS, PbSe and PbTe Locality: synthetic Sample: T = 120 K Acta Crystallographica, Section C, 1987, 43, 1443-1445 |
| 9011358 | CIF | Pb Te | F m -3 m | 6.4541; 6.4541; 6.4541 90; 90; 90 | 268.848 | Noda, Y.; Masumoto, K.; Ohba, S.; Saito, Y.; Toriumi, K.; Iwata, Y.; Shibuya, I. Temperature dependence of atomic thermal parameters of lead chalcogenides, PbS, PbSe and PbTe Locality: synthetic Sample: T = 298 K Acta Crystallographica, Section C, 1987, 43, 1443-1445 |
| 9011359 | CIF | Pb Se | F m -3 m | 6.1054; 6.1054; 6.1054 90; 90; 90 | 227.584 | Noda, Y.; Masumoto, K.; Ohba, S.; Saito, Y.; Toriumi, K.; Iwata, Y.; Shibuya, I. Temperature dependence of atomic thermal parameters of lead chalcogenides, PbS, PbSe and PbTe Locality: synthetic Sample: T = 120 K Acta Crystallographica, Section C, 1987, 43, 1443-1445 |
| 9011360 | CIF | Pb Se | F m -3 m | 6.1213; 6.1213; 6.1213 90; 90; 90 | 229.367 | Noda, Y.; Masumoto, K.; Ohba, S.; Saito, Y.; Toriumi, K.; Iwata, Y.; Shibuya, I. Temperature dependence of atomic thermal parameters of lead chalcogenides, PbS, PbSe and PbTe Locality: synthetic Sample: T = 298 K Acta Crystallographica, Section C, 1987, 43, 1443-1445 |
| 9011361 | CIF | Cu Fe2 H2 O10 P2 | P 1 21/n 1 | 6.984; 7.786; 7.266 90; 117.68; 90 | 349.889 | Sieber, N. H. W.; Tillmanns, E.; Hofmeister, W. Structure of hentschelite, CuFe2(PO4)2(OH)2, a new member of the lazulite group Locality: silicified barite vein, Reichenbach, Odenwald, Germany Acta Crystallographica, Section C, 1987, 43, 1855-1857 |
| 9011362 | CIF | S8 | F d d d :2 | 10.4646; 12.866; 24.486 90; 90; 90 | 3296.74 | Rettig, S. J.; Trotter, J. Refinement of the structure of orthorhombic sulfur, alpha-S8 Locality: synthetic Sample: at T = 298 K Note: alpha phase Acta Crystallographica, Section C, 1987, 43, 2260-2262 |
| 9011363 | CIF | S8 | F d d d :2 | 10.4646; 12.866; 24.486 90; 90; 90 | 3296.74 | Rettig, S. J.; Trotter, J. Refinement of the structure of orthorhombic sulfur, alpha-S8 Locality: synthetic Sample: at T = 298 K Note: alpha phase Note: coordinate positions of atoms correspond to high-angle refinements Acta Crystallographica, Section C, 1987, 43, 2260-2262 |
| 9011364 | CIF | Ca H12 O17 Si2 U2 | P 1 21 1 | 15.909; 7.002; 6.665 90; 97.27; 90 | 736.478 | Ginderow, D. Structure de l'uranophane alpha, Ca(UO2)2(SiO3OH)2*5H2O Acta Crystallographica, Section C, 1988, 44, 421-424 |
| 9011365 | CIF | Co H12 O10 S | C 1 2/c 1 | 10.022; 7.217; 24.224 90; 98.42; 90 | 1733.21 | Elerman, Y. Refinement of the crystal structure of CoSO4*6H2O Acta Crystallographica, Section C, 1988, 44, 599-601 |
| 9011366 | CIF | H12 Ni O10 S | P 41 21 2 | 6.78; 6.78; 18.285 90; 90; 90 | 840.532 | Angel, R. J.; Finger, L. W. Polymorphism of nickel sulfate hexahydrate Acta Crystallographica, Section C, 1988, 44, 1869-1873 |
| 9011367 | CIF | H12 Ni O10 S | C 1 2/c 1 | 9.88; 7.228; 24.13 90; 98.38; 90 | 1704.79 | Angel, R. J.; Finger, L. W. Polymorphism of nickel sulfate hexahydrate Acta Crystallographica, Section C, 1988, 44, 1869-1873 |
| 9011368 | CIF | C5 Ca1.16 Ce1.2 Na3.4 O15 Sr0.24 | P 1 1 21 | 10.412; 10.414; 6.291 90; 90; 119.8 | 591.935 | Ginderow, D. Structure de Na3M3(CO3)5 (M = Terre Rare, Ca Na Sr), rattache a la burbankite Acta Crystallographica, Section C, 1989, 45, 185-187 |
| 9011369 | CIF | Fe H20 N2 O14 S2 | P 1 21/a 1 | 9.167; 12.405; 6.305 90; 106.71; 90 | 686.707 | Figgis, B. N.; Kucharski, E. S.; Reynolds, P. A.; Tasset, F. The structure of (ND4)2Fe(SO4)2*6D2O at 4.3 K by neutron diffraction Acta Crystallographica, Section C, 1989, 45, 942-944 |
| 9011370 | CIF | C5 Ca1.15 Ce1.22 Na3.4 O15 Sr0.24 | C m c 21 | 10.444; 18.01799; 6.291 90; 90; 90 | 1183.84 | Marsh, R. E. Structure of Na3M3(CO3)5. Corrigendum Acta Crystallographica, Section C, 1989, 45, 1840-1840 |
| 9011372 | CIF | Fe S4 Sb2 | P n a m | 11.401; 14.148; 3.758 90; 90; 90 | 606.17 | Lemoine, P.; Carre, D.; Robert, F. Structure du sulfure de fer et d'antimoine, FeSb2S4 (Berthierite) Acta Crystallographica, Section C, 1991, 47, 938-940 |
| 9011373 | CIF | As Ca2 O12 W2 Y | I 41/a :2 | 5.135; 5.135; 33.882 90; 90; 90 | 893.408 | Demartin, F.; Gramaccioli, C. M.; Pilati, T. Structure of a new natural tungstate arsenate, [Ca2Y(AsO4)(WO4)2], structurally related to scheelite Locality: Alpine fissures, Pizzo Cervandone area, Ossola Valley, Italy Note: anisoU's from ICSD Acta Crystallographica, Section C, 1992, 48, 1357-1359 |
| 9011374 | CIF | Al4.44 Ca5.76 Cl2.76 Fe0.48 Mg0.24 O16 Si2.08 | I -4 3 d | 12.001; 12.001; 12.001 90; 90; 90 | 1728.43 | Tsukimura, K.; Kanazawa, Y.; Aoki, M.; Bunno, M. Structure of wadalite Ca6Al5Si2O16Cl3 Note: the values for the anisoU's are from ICSD Acta Crystallographica, Section C, 1993, 49, 205-207 |
| 9011377 | CIF | B5 Ca2 Cl H2 O10 | P 1 | 6.452; 6.559; 6.286 61.6; 118.72; 105.86 | 204.867 | Burns, P. C.; Hawthorne, F. C. Refinement of the structure of hilgardite-1A Locality: Penobsquis potash deposit, Sussex, New Brunswick Acta Crystallographica, Section C, 1994, 50, 653-655 |
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