Crystallography Open Database
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Searching space group like 'P 31 2 1'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9008088 | CIF | Bi O4 P | P 31 2 1 | 6.966; 6.966; 6.46 90; 90; 120 | 271.475 | Mooney-Slater R C L Polymorphic forms of bismuth phosphate Zeitschrift fur Kristallographie, 1962, 117, 371-385 |
| 9008093 | CIF | O2 Si | P 31 2 1 | 5.01; 5.01; 5.47 90; 90; 120 | 118.903 | Arnold, H. Die struktur des hochquarzes Note: sample is at T = 650 deg C, under the false assumption that it is twinned Zeitschrift fur Kristallographie, 1962, 117, 467-469 |
| 9008400 | CIF | Al As O4 | P 31 2 1 | 5.028; 5.028; 11.228 90; 90; 120 | 245.824 | Sowa, H. The crystal structure of AlAsO4 at high pressure Note: P = 0 GPa Zeitschrift fur Kristallographie, 1991, 194, 291-304 |
| 9008401 | CIF | Al As O4 | P 31 2 1 | 5.03; 5.03; 11.234 90; 90; 120 | 246.151 | Sowa, H. The crystal structure of AlAsO4 at high pressure Note: P = 0 GPa, in the diamond anvil cell Zeitschrift fur Kristallographie, 1991, 194, 291-304 |
| 9008402 | CIF | Al As O4 | P 31 2 1 | 4.945; 4.945; 11.135 90; 90; 120 | 235.805 | Sowa, H. The crystal structure of AlAsO4 at high pressure Note: P = 1.81 GPa Zeitschrift fur Kristallographie, 1991, 194, 291-304 |
| 9008403 | CIF | Al As O4 | P 31 2 1 | 4.873; 4.873; 11.071 90; 90; 120 | 227.672 | Sowa, H. The crystal structure of AlAsO4 at high pressure Note: P = 2.99 GPa Zeitschrift fur Kristallographie, 1991, 194, 291-304 |
| 9008404 | CIF | Al As O4 | P 31 2 1 | 4.799; 4.799; 11.003 90; 90; 120 | 219.454 | Sowa, H. The crystal structure of AlAsO4 at high pressure Note: P = 4.87 GPa Zeitschrift fur Kristallographie, 1991, 194, 291-304 |
| 9009666 | CIF | O2 Si | P 31 2 1 | 4.9158; 4.9158; 5.4091 90; 90; 120 | 113.199 | Gualtieri, A. F. Accuracy of XRPD QPA using the combined Rietveld-RIR method Journal of Applied Crystallography, 2000, 33, 267-278 |
| 9009779 | CIF | Al0.96 Ca1.538 O14 Th0.302 Ti2.6 Zr2.6 | P 31 2 1 | 7.228; 7.228; 16.805 90; 90; 120 | 760.336 | Grey, I. E.; Mumme, W. G.; Ness, T. J.; Roth, R. S.; Smith, K. L. Structural relations between weberite and zirconolite polytypes - refinements of doped 3T and 4M Ca2Ta2O7 and 3T CaZrTi2O7 Locality: synthetic Sample: T = 123 K Note: polytype Zirconolite-3T Journal of Solid State Chemistry, 2003, 174, 285-295 |
| 9010240 | CIF | Ca3 Mg0.017 Mn O14 Sb3.983 | P 31 2 1 | 7.282; 7.282; 17.604 90; 90; 120 | 808.432 | Bonazzi, P.; Bindi, L. The crystal structure of ingersonite, Ca3Mn2+Sb5+4O14, and its relationships with pyrochlore Locality: Langban mine, Varmland, Sweden American Mineralogist, 2007, 92, 947-953 |
| 9010367 | CIF | Al O4 P | P 31 2 1 | 4.9458; 4.9458; 10.9526 90; 90; 120 | 232.018 | Onac, B. P.; Effenberger, H. S. Re-examination of berlinite (AlPO4) from the Cioclovina Cave, Romania American Mineralogist, 2007, 92, 1998-2001 |
| 9011493 | CIF | O2 Si | P 31 2 1 | 4.921; 4.921; 5.4163 90; 90; 120 | 113.59 | Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F. Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = room pressure Zeitschrift fur Kristallographie, 1992, 198, 177-212 |
| 9011494 | CIF | O2 Si | P 31 2 1 | 4.775; 4.775; 5.3046 90; 90; 120 | 104.744 | Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F. Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = 4.0GPa = 40 kbar Zeitschrift fur Kristallographie, 1992, 198, 177-212 |
| 9011495 | CIF | O2 Si | P 31 2 1 | 4.6764; 4.6764; 5.2475 90; 90; 120 | 99.382 | Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F. Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = 7.2GPa = 72 kbar Zeitschrift fur Kristallographie, 1992, 198, 177-212 |
| 9011496 | CIF | O2 Si | P 31 2 1 | 4.604; 4.604; 5.207 90; 90; 120 | 95.585 | Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F. Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = 10.2GPa = 102 kbar Zeitschrift fur Kristallographie, 1992, 198, 177-212 |
| 9011648 | CIF | Se | P 31 2 1 | 4.368; 4.368; 4.958 90; 90; 120 | 81.922 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011649 | CIF | Se | P 31 2 1 | 4.052; 4.052; 5.038 90; 90; 120 | 71.635 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 2.58 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011650 | CIF | Se | P 31 2 1 | 3.956; 3.956; 5.069 90; 90; 120 | 68.701 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 4.15 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011651 | CIF | Se | P 31 2 1 | 3.91; 3.91; 5.08 90; 90; 120 | 67.259 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 4.99 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011652 | CIF | Se | P 31 2 1 | 3.846; 3.846; 5.095 90; 90; 120 | 65.267 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 6.57 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011653 | CIF | Se | P 31 2 1 | 3.81; 3.81; 5.11 90; 90; 120 | 64.239 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 7.70 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011654 | CIF | Se | P 31 2 1 | 3.779; 3.779; 5.109 90; 90; 120 | 63.186 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 8.64 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9012072 | CIF | C H2 Ca O4 | P 31 2 1 | 6.0931; 6.0931; 7.5446 90; 90; 120 | 242.574 | Effenberger, E. Kristallstruktur und infrarot-absorptionsspektrum von synthetischem monohydrocalcit, CaCO3*H2O Substructure Monatshefte fur Chemie, 1981, 112, 899-909 |
| 9012282 | CIF | Ca3.906 Nd0.154 O14 Ta3.78 Zr0.16 | P 31 2 1 | 7.356; 7.356; 18.116 90; 90; 120 | 848.939 | Grey, I. E.; Mumme, W. G.; Ness, T. J.; Roth, R. S.; Smith, K. L. Structural relations between weberite and zirconolite polytypes - refinements of doped 3T and 4M Ca2Ta2O7 and 3T CaZrTi2O7 Sample: T = 123 K, 3T weberite-type structure Journal of Solid State Chemistry, 2003, 174, 285-295 |
| 9012501 | CIF | Se | P 31 2 1 | 4.3662; 4.3662; 4.9536 90; 90; 120 | 81.782 | Cherin, P.; Unger, P. The crystal structure of trigonal selenium Inorganic Chemistry, 1967, 6, 1589-1591 |
| 9012512 | CIF | Fe O4 P | P 31 2 1 | 5.036; 5.036; 11.255 90; 90; 120 | 247.199 | Long, G. J.; Cheetham, A. K.; Battle, P. D. Study of the iron-phosphorus-oxygen system by Mossbauer effect, neutron diffraction, magnetic susceptibility, and analytical electron microscopy: some pitfalls and solutions in the analysis of a complex mixture Inorganic Chemistry, 1983, 22, 3012-3016 |
| 9012600 | CIF | O2 Si | P 31 2 1 | 4.914; 4.914; 5.406 90; 90; 120 | 113.052 | Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 1 bar Solid State Communications, 1989, 72, 507-511 |
| 9012601 | CIF | O2 Si | P 31 2 1 | 4.812; 4.812; 5.327 90; 90; 120 | 106.823 | Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 2.0 Gpa Solid State Communications, 1989, 72, 507-511 |
| 9012602 | CIF | O2 Si | P 31 2 1 | 4.705; 4.705; 5.25 90; 90; 120 | 100.649 | Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 5.1 GPa Solid State Communications, 1989, 72, 507-511 |
| 9012603 | CIF | O2 Si | P 31 2 1 | 4.625; 4.625; 5.216 90; 90; 120 | 96.625 | Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 8.0 GPa Solid State Communications, 1989, 72, 507-511 |
| 9012604 | CIF | O2 Si | P 31 2 1 | 4.594; 4.594; 5.2 90; 90; 120 | 95.042 | Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 9.5 GPa Solid State Communications, 1989, 72, 507-511 |
| 9012605 | CIF | O2 Si | P 31 2 1 | 4.535; 4.535; 5.17 90; 90; 120 | 92.082 | Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 12.5 GPa Solid State Communications, 1989, 72, 507-511 |
| 9013559 | CIF | Ca2.8 Mg0.12 Mn1.12 O14 Sb3.96 | P 31 2 1 | 7.279; 7.279; 17.667 90; 90; 120 | 810.657 | Zanazzi, P. F.; Chelazzi, L.; Bonazzi, P.; Bindi, L. High-pressure structural behavior of ingersonite, Ca3Mn2+Sb45+O14: An in-situ single-crystal X-ray study Note: P = 0.0001 GPa American Mineralogist, 2009, 94, 352-358 |
| 9013560 | CIF | Ca2.8 Mg0.12 Mn1.12 O14 Sb3.96 | P 31 2 1 | 7.243; 7.243; 17.57 90; 90; 120 | 798.251 | Zanazzi, P. F.; Chelazzi, L.; Bonazzi, P.; Bindi, L. High-pressure structural behavior of ingersonite, Ca3Mn2+Sb45+O14: An in-situ single-crystal X-ray study Note: P = 2.25 GPa American Mineralogist, 2009, 94, 352-358 |
| 9013561 | CIF | Ca2.8 Mg0.12 Mn1.12 O14 Sb3.96 | P 31 2 1 | 7.218; 7.218; 17.51 90; 90; 120 | 790.043 | Zanazzi, P. F.; Chelazzi, L.; Bonazzi, P.; Bindi, L. High-pressure structural behavior of ingersonite, Ca3Mn2+Sb45+O14: An in-situ single-crystal X-ray study Note: P = 4.23 GPa American Mineralogist, 2009, 94, 352-358 |
| 9013562 | CIF | Ca2.8 Mg0.12 Mn1.12 O14 Sb3.96 | P 31 2 1 | 7.204; 7.204; 17.45 90; 90; 120 | 784.284 | Zanazzi, P. F.; Chelazzi, L.; Bonazzi, P.; Bindi, L. High-pressure structural behavior of ingersonite, Ca3Mn2+Sb45+O14: An in-situ single-crystal X-ray study Note: P = 5.41 GPa American Mineralogist, 2009, 94, 352-358 |
| 9013563 | CIF | Ca2.8 Mg0.12 Mn1.12 O14 Sb3.96 | P 31 2 1 | 7.182; 7.182; 17.465 90; 90; 120 | 780.171 | Zanazzi, P. F.; Chelazzi, L.; Bonazzi, P.; Bindi, L. High-pressure structural behavior of ingersonite, Ca3Mn2+Sb45+O14: An in-situ single-crystal X-ray study Note: P = 6.38 GPa American Mineralogist, 2009, 94, 352-358 |
| 9013564 | CIF | Ca2.8 Mg0.12 Mn1.12 O14 Sb3.96 | P 31 2 1 | 7.17; 7.17; 17.406 90; 90; 120 | 774.94 | Zanazzi, P. F.; Chelazzi, L.; Bonazzi, P.; Bindi, L. High-pressure structural behavior of ingersonite, Ca3Mn2+Sb45+O14: An in-situ single-crystal X-ray study Note: P = 7.42 GPa American Mineralogist, 2009, 94, 352-358 |
| 9015008 | CIF | B4 La4 O15 Si3 | P 31 2 1 | 6.827; 6.827; 6.779 90; 90; 120 | 273.625 | Belokoneva, E. L.; Shuvaeva, V. A.; Antipin M Yu; Leonyuk, N. I. Crystal structure of a high-temperature modification of LaBSiO5, a synthetic analog of stillwellite Note: T = 473 K Zhurnal Neorganicheskoi Khimii, 1996, 41, 1097-1101 |
| 9015938 | CIF | Ce H2 O5 P | P 31 2 1 | 7.055; 7.055; 6.439 90; 90; 120 | 277.551 | Mooney, R. C. L. Crystal structures of a series of rare earth phosphates Journal of Chemical Physics, 1948, 16, 1003-1003 |
| 9015968 | CIF | B Nd O5 Si | P 31 2 1 | 6.8035; 6.8035; 6.6487 90; 90; 120 | 266.521 | Shi, Y.; Liang, J. K.; Zhang, H.; Yang, J. L.; Zhuang, W. D.; Rao, G. H. Crystal structure and vibrational spectra studies of stillwellite compounds NdBSiO5 Journal of Alloys and Compounds, 1997, 259, 163-169 |
| 9017201 | CIF | Be2 Fe2 H12 Mn O22 P4 | P 31 2 1 | 9.404; 9.404; 15.92 90; 90; 120 | 1219.27 | Cooper, M. A.; Hawthorne, F. C. The crystal structure of faheyite, Mn2+Fe3+2[Be2(PO4)4](H2O)6: a new twist for the [Be(PPhi4)2] chain The Canadian Mineralogist, 2015, 53, 199-208 |
| 9017339 | CIF | Ca H1.62 O4.81 S | P 31 2 1 | 6.968; 6.968; 6.41 90; 90; 120 | 269.529 | Abriel, W. Calcium sulfat subhydrat, CaSO4.0,8H2O Acta Crystallographica, Section C, 1983, 39, 956-958 |
| 9017374 | CIF | Ca H O4.5 S | P 31 2 1 | 6.937; 6.937; 6.345 90; 90; 120 | 264.427 | Abriel, W.; Nesper, R. Bestimmung der Kristallstruktur von CaSO4(H2O)0.5 mit Rontgenbeugungsmethoden und mit Potentialprofil-Rechnungen Zeitschrift fur Kristallographie, 1993, 205, 99-113 |
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