Crystallography Open Database
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Searching space group like 'P 21 21 21'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9009893 | CIF | Co5 H4 O12 P2 | P 21 21 21 | 8.903; 17.397; 5.5154 90; 90; 90 | 854.255 | Ruszala, F. A.; Anderson, J. B.; Kostiner, E. Crystal structures of two isomorphs of arsenoclasite: Co5(PO4)2(OH)4 and Mn5(PO4)2(OH)4 Locality: synthetic Inorganic Chemistry, 1977, 16, 2417-2422 |
| 9010743 | CIF | D14 Mg O11 S | P 21 21 21 | 11.897133; 11.90851; 6.78729 90; 90; 90 | 961.604 | Fortes, A. D.; Wood, I. G.; Alfredsson, M.; Vocadlo, L.; Knight, K. S. The thermoelastic properties of MgSO4*7D2O (epsomite) from powder neutron diffraction and ab initio calculation Locality: synthetic Sample: T = 2 K European Journal of Mineralogy, 2006, 18, 449-462 |
| 9011107 | CIF | Nd2 O7 Si2 | P 21 21 21 | 5.394; 12.95; 8.72 90; 90; 90 | 609.112 | Smolin, Y. I.; Shepelev, Y. F. The crystal structures of the rare earth pyrosilicates Acta Crystallographica, Section B, 1970, 26, 484-492 |
| 9011395 | CIF | As Ca Co0.95 Cu0.05 H O5 | P 21 21 21 | 7.4919; 8.9946; 5.9158 90; 90; 90 | 398.646 | Yang, H.; Costin, G.; Keogh, J.; Lu, R.; Downs, R. T. Cobaltaustinite, CaCo(AsO4)(OH) Acta Crystallographica, Section E, 2007, 63, i53-i55 |
| 9011513 | CIF | Mg Na O4 P | P 21 21 21 | 8.828; 6.821; 15.25 90; 90; 90 | 918.291 | Alkemper, J.; Fuess, H. The crystal structures of NaMgPO~4~, Na~2~CaMg(PO~4~)~2~ and Na~18~Ca~13~Mg~5~(PO~4~)~18~: new examples for glaserite related structures Zeitschrift für Kristallographie, 1998, 213, 282-287 |
| 9011811 | CIF | C O4 Pb2 | P 21 21 21 | 5.1465; 9.014; 9.315 90; 90; 90 | 432.128 | Krivovichev, S. V.; Burns, P. C. Crystal chemistry of basic lead carbonates. I. Crystal structure of synthetic shannonite, Pb2O(CO3) Locality: synthetic Mineralogical Magazine, 2000, 64, 1063-1068 |
| 9011883 | CIF | H14 Ni O11 S | P 21 21 21 | 11.768; 12.021; 6.758 90; 90; 90 | 956.008 | Iskhakova, L. D.; Dubrovinskii, L. S.; Charushnikova, I. A. Crystal structure, theoretical parameters of potential of atomic interaction (PPAI), and thermochemical properties of NiSO4*nH2O (n=7,6) Soviet Physics Crystallography, 1991, 36, 360-363 |
| 9012218 | CIF | H In2 K2 O10 P2 | P 21 21 21 | 9.277; 9.339; 11.245 90; 90; 90 | 974.243 | Hriljac, J. A.; Grey, C. P.; Cheetham, A. K.; VerNooy, P. D.; Torardi, C. C. Synthesis and structure of KIn(OH)PO4: Chains of hydroxide-bridged InO4(OH)2 octahedra Journal of Solid State Chemistry, 1996, 123, 243-248 |
| 9012333 | CIF | S18 | P 21 21 21 | 21.152; 11.441; 7.581 90; 90; 90 | 1834.6 | Schmidt, V. M.; Wilhelm, E.; Debaerdemaeker, T.; Hellner, E.; Kutoglu, A. Darstellung und kristallstruktur von cyclooktadekaschwefel, S18, und cycloikosaschwefel, S20 Note: structure for S18 Zeitschrift fur Anorganische und Allgemeine Chemie, 1974, 405, 153-162 |
| 9012343 | CIF | As O5 Sb | P 21 21 21 | 9.1607; 8.7524; 4.9035 90; 90; 90 | 393.153 | Jansen, M.; Begemann, B.; Geb, J. Mischkristallbildung in den systemen As2O5/SbAsO5 und As2O5/AsPO5 bestimmung der spontanen deformationen und verfeinerung der kristallstrukturen der ternaren randphasen Zeitschrift fur Anorganische und Allgemeine Chemie, 1992, 610, 139-144 |
| 9012344 | CIF | As O5 P | P 21 21 21 | 8.417; 8.171; 4.536 90; 90; 90 | 311.965 | Jansen, M.; Begemann, B.; Geb, J. Mischkristallbildung in den Systemen As2O5/SbAsO5 und As2O5/AsPO5: bestimmung der spontanen deformationen und verfeinerung der kristallstrukturen der ternaren randphasen Zeitschrift fur Anorganische und Allgemeine Chemie, 1992, 610, 139-144 |
| 9012353 | CIF | Be D2 O2 | P 21 21 21 | 4.5356; 4.6317; 7.0379 90; 90; 90 | 147.849 | Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 245 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254 |
| 9012354 | CIF | Be D2 O2 | P 21 21 21 | 4.526; 4.6318; 7.0192 90; 90; 90 | 147.147 | Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 50 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254 |
| 9012355 | CIF | Be D2 O2 | P 21 21 21 | 4.5259; 4.6314; 7.0193 90; 90; 90 | 147.133 | Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 5 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254 |
| 9012356 | CIF | D2 O2 Zn | P 21 21 21 | 4.90855; 5.14641; 8.488 90; 90; 90 | 214.419 | Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 298 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254 |
| 9012357 | CIF | D2 O2 Zn | P 21 21 21 | 4.88877; 5.12854; 8.5029 90; 90; 90 | 213.187 | Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 120 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254 |
| 9012358 | CIF | D2 O2 Zn | P 21 21 21 | 4.88626; 5.12609; 8.5066 90; 90; 90 | 213.068 | Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 50 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254 |
| 9012359 | CIF | D2 O2 Zn | P 21 21 21 | 4.88564; 5.12565; 8.50702 90; 90; 90 | 213.033 | Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 5 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254 |
| 9012418 | CIF | Al2 Ca H4 O10 Si2 | P 21 21 21 | 13.902; 8.892; 13.952 90; 90; 90 | 1724.7 | Vezzalini, G.; Quartieri, S.; Alberti, A. Structural modifications induced by dehydration in the zeolite gismondine Locality: Montalto di Castro, Italy Sample: dehydration t = 24 hr Zeolites, 1993, 13, 34-42 |
| 9012622 | CIF | Li Na5 O8 P2 | P 21 21 21 | 10.124; 14.794; 10.132 90; 90; 90 | 1517.52 | Rastsvetaeva, R. K.; Khomyakov, A. P. A comparative crystal-chemical study of the lithium-sodium phosphates (lithiophosphate, nalipoite, olympite, and Na3PO4) Note: O5(y) made negative to match reported bond distances Crystallography Reports, 1994, 39, 35-41 |
| 9012715 | CIF | Cu2 H3 N O6 | P 21 21 21 | 6.087; 13.813; 5.597 90; 90; 90 | 470.594 | Bovio, B.; Locchi, S. Crystal structure of the orthorhombic basic copper nitrate, Cu2(OH)3NO3 Journal of Crystallographic and Spectroscopic Research, 1982, 12, 507-517 |
| 9012798 | CIF | As0.931 Ca H Mg O5 P0.069 | P 21 21 21 | 7.468; 8.953; 5.941 90; 90; 90 | 397.221 | Effenberger, H.; Krause, W.; Bernhardt, H. J. Structural investigations of adelite and cobaltaustinite, two members of the adelite-descloizite group Experimental Mineralogy, Petrology and Geochemistry Abstract Volume, 2002, 9, 30-30 |
| 9012846 | CIF | As2 O5 | P 21 21 21 | 8.646; 8.45; 4.626 90; 90; 90 | 337.97 | Jansen, M. Kristallstruktur von As2O5 Angewandte Chemie, 1977, 89, 326-327 |
| 9013406 | CIF | H14 Ni O11 S | P 21 21 21 | 11.82; 12.02; 6.81 90; 90; 90 | 967.54 | Beevers, C. A.; Schwartz, C. M. The crystal structure of nickel sulphate heptahydrate NiSO4*7H2O Note: hydrogen positions from Acta Crystallographica B24 (1968) 1131-1133 Note: all atoms shifted .25, 0, 0 Zeitschrift fur Kristallographie, 1935, 91, 157-169 |
| 9013441 | CIF | Bi Cu Pt S3 | P 21 21 21 | 7.7152; 12.838; 4.9248 90; 90; 90 | 487.79 | Yu, Z.; Cheng, F.; Ma, H. Lisiguangite, CuPtBiS3, a new platinum-group mineral from the Yanshan Mountains, Hebei, China Locality: Yanshan Mountains, Hebei, China Acta Geologica Sinica, 2009, 83, 238-244 |
| 9013493 | CIF | O2 Si | P 21 21 21 | 26.163; 4.987; 8.199 90; 90; 90 | 1069.76 | Hirose, T.; Kihara, K.; Okuno, M.; Fujinami, S.; Shinoda, K. X-ray, DTA and Raman studies of monoclinic tridymite and its higher temperature orthorhombic modification with varying temperature. Note: T = 413 K Journal of Mineralogical and Petrological Sciences, 2005, 100, 55-69 |
| 9013618 | CIF | H4 Mg O6 S | P 21 21 21 | 8.8932; 8.4881; 12.4401 90; 90; 90 | 939.058 | Ma, H.; Bish, D. L.; Wang, H. W.; Chipera, S. J. Determination of the crystal structure of sanderite, MgSO4*2H2O, by X-ray powder diffraction and the charge flipping method Locality: synthetic Note: x-coordinate of O4 changed by the author American Mineralogist, 2009, 94, 622-625 |
| 9013995 | CIF | C H2 Ca4 O10.99 Si1.98 | P 21 21 21 | 3.786; 10.916; 23.379 90; 90; 90 | 966.207 | Rastsvetaeva, R. K.; Bolotina, N. B.; Zadov, A. E.; Chukanov, N. V. Crystal structure of fukalite dimorph Ca4[Si2O6](CO3)(OH)2 from the Gumeshevsk Deposit the Urals Doklady Earth Sciences, 2005, 1347-1351 |
| 9014489 | CIF | C H Gd O4 | P 21 21 21 | 7.0755; 4.8739; 8.4471 90; 90; 90 | 291.301 | Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S. Crystal chemistry of RE(CO3)OH Zeitschrift fur Kristallographie, 2007, 222, 326-334 |
| 9014623 | CIF | Cu H4 O5 Se | P 21 21 21 | 6.666; 9.169; 7.373 90; 90; 90 | 450.642 | Pasero, M.; Perchiazzi, N. Chalcomenite from Baccu Locci, Sardinia, Italy: mineral data and structure refinement Neues Jahrbuch fur Mineralogie, Monatshefte, 1989, 1989, 551-556 |
| 9014709 | CIF | C H Eu O4 | P 21 21 21 | 7.1002; 4.8932; 8.453 90; 90; 90 | 293.68 | Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S. Crystal chemistry of RE(CO3)OH Zeitschrift fur Kristallographie, 2007, 222, 326-334 |
| 9014803 | CIF | Be H2 O2 | P 21 21 21 | 4.5328; 4.6252; 7.0379 90; 90; 90 | 147.55 | Stahl, R.; Jung, C.; Lutz, H. D.; Kockelmann, W.; Jacobs, H. Kristallstrukturen und Wasserstoffbruckenbindungen bei beta-Be(OH)2 und epsilon-Zn(OH)2 Note: combined X-ray and Neutron diffraction Zeitschrift fur Anorganische und Allgemeine Chemie, 1998, 624, 1130-1136 |
| 9014825 | CIF | C H O4 Y | P 21 21 21 | 6.9591; 4.8141; 8.4722 90; 90; 90 | 283.834 | Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S. Crystal chemistry of RE(CO3)OH Zeitschrift fur Kristallographie, 2007, 222, 326-334 |
| 9014848 | CIF | As Ca Cu0.96 H Mg0.04 O5 | P 21 21 21 | 7.3849; 5.8379; 9.1937 90; 90; 90 | 396.362 | Sakai, S.; Yoshiasa, A.; Sugiyama, K.; Miyawaki, R. Crystal structure and chemistry of conichalcite, CaCu(AsO4)(OH) Journal of Mineralogical and Petrological Sciences, 2009, 104, 125-131 |
| 9014857 | CIF | H6 Mg O6 Si | P 21 21 21 | 4.976; 5.023; 7.115 90; 89.89; 90 | 177.835 | Wunder, B.; Jahn, S.; Koch-Muller M; Speziale, S. The 3.65 A phase, MgSi(OH)6: structural insights from DFT-calculations and T-dependent IR spectroscopy Note: theoretical structure, LDA from P2_12_12_1 American Mineralogist, 2012, 97, 1043-1048 |
| 9014914 | CIF | As0.06 H4 Mn5 O12 P1.76 Si0.18 | P 21 21 21 | 17.9733; 5.6916; 9.13 90; 90; 90 | 933.97 | Elliott, P.; Pring, A. The crystal structure of gatehouseite Mineralogical Magazine, 2011, 75, 2823-2832 |
| 9015158 | CIF | Be D2 O2 | P 21 21 21 | 4.5336; 4.6255; 7.0384 90; 90; 90 | 147.596 | Stahl, R.; Jung, C.; Lutz, H. D.; Kockelmann, W.; Jacobs, H. Kristallstrukturen und Wasserstoffbruckenbindungen bei beta-Be(OH)2 und epsilon-Zn(OH)2 Note: Neutron diffraction Zeitschrift fur Anorganische und Allgemeine Chemie, 1998, 624, 1130-1136 |
| 9015295 | CIF | C H O4 Tm | P 21 21 21 | 6.9028; 4.7833; 8.5086 90; 90; 90 | 280.938 | Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S. Crystal chemistry of RE(CO3)OH Zeitschrift fur Kristallographie, 2007, 222, 326-334 |
| 9015327 | CIF | As Cu2 H7 O8 | P 21 21 21 | 10.506; 10.506; 6.103 90; 90; 90 | 673.625 | Eby, R. K.; Hawthorne, F. C. Euchroite, a heteropolyhedral framework structure Acta Crystallographica, Section C, 1989, 45, 1479-1482 |
| 9015477 | CIF | Cu2 H2 O7 Pb Te | P 21 21 21 | 5.1943; 9.6198; 11.6746 90; 90; 90 | 583.358 | Kampf, A. R.; Mills, S. J.; Housley, R. M.; Marty, J.; Thorne, B. Lead-tellurium oxysalts from Otto Mountain near Baker, California: V. Timroseite, Pb2Cu2+5(Te6+O6)2(OH)2, and paratimroseite, Pb2Cu2+4(Te6+O6)2(H2O)2, two new tellurates with Te-Cu polyhedral sheets American Mineralogist, 2010, 95, 1560-1568 |
| 9015545 | CIF | H2 O2 Zn | P 21 21 21 | 4.905; 5.143; 8.473 90; 90; 90 | 213.743 | Stahl, R.; Jung, C.; Lutz, H. D.; Kockelmann, W.; Jacobs, H. Kristallstrukturen und Wasserstoffbruckenbindungen bei beta-Be(OH)2 und epsilon-Zn(OH)2 Note: X-ray single-crystal Zeitschrift fur Anorganische und Allgemeine Chemie, 1998, 624, 1130-1136 |
| 9015629 | CIF | Be H2 O2 | P 21 21 21 | 4.53; 4.621; 7.048 90; 90; 90 | 147.537 | Stahl, R.; Jung, C.; Lutz, H. D.; Kockelmann, W.; Jacobs, H. Kristallstrukturen und Wasserstoffbruckenbindungen bei beta-Be(OH)2 und epsilon-Zn(OH)2 Note: X-ray single-crystal Zeitschrift fur Anorganische und Allgemeine Chemie, 1998, 624, 1130-1136 |
| 9015908 | CIF | C H Ho O4 | P 21 21 21 | 6.9583; 4.8121; 8.4558 90; 90; 90 | 283.134 | Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S. Crystal chemistry of RE(CO3)OH Zeitschrift fur Kristallographie, 2007, 222, 326-334 |
| 9015977 | CIF | K2 O10 Si3 Ti | P 21 21 21 | 7.1362; 9.9084; 12.9414 90; 90; 90 | 915.065 | Dadachov, M.; Le Bail, A. Structure of zeolitic K2TiSi3O9*(H2O) determined ab initio from powder diffraction data _cod_database_code 1000136 European Journal of Solid State and Inorganic Chemistry, 1997, 34, 381-390 |
| 9016089 | CIF | C H O4 Tb | P 21 21 21 | 7.0256; 4.8577; 8.4657 90; 90; 90 | 288.92 | Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S. Crystal chemistry of RE(CO3)OH Zeitschrift fur Kristallographie, 2007, 222, 326-334 |
| 9016258 | CIF | As Ca Cu0.87 H Mg0.13 O5 | P 21 21 21 | 7.429; 5.852; 9.215 90; 90; 90 | 400.618 | Sakai, S.; Yoshiasa, A.; Sugiyama, K.; Miyawaki, R. Crystal structure and chemistry of conichalcite, CaCu(AsO4)(OH) Journal of Mineralogical and Petrological Sciences, 2009, 104, 125-131 |
| 9016264 | CIF | C H Er O4 | P 21 21 21 | 6.9386; 4.7963; 8.4863 90; 90; 90 | 282.421 | Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S. Crystal chemistry of RE(CO3)OH Zeitschrift fur Kristallographie, 2007, 222, 326-334 |
| 9016350 | CIF | Be H7.532 Na2 O13.766 Si4 | P 21 21 21 | 9.7128; 10.1352; 11.8919 90; 90; 90 | 1170.65 | Armstrong, J. A.; Friis, H.; Lieb, A.; Finch, A. A.; Weller, M. T. Combined single-crystal X-ray and neutron powder diffraction structure analysis exemplified through full structure determinations of framework and layer beryllate minerals American Mineralogist, 2010, 95, 519-526 |
| 9016368 | CIF | H6 Mg O6 Si | P 21 21 21 | 5.173; 5.21; 7.371 90; 89.88; 90 | 198.658 | Wunder, B.; Jahn, S.; Koch-Muller M; Speziale, S. The 3.65 A phase, MgSi(OH)6: structural insights from DFT-calculations and T-dependent IR spectroscopy Note: theoretical structure, GGA from P2_12_12_1 American Mineralogist, 2012, 97, 1043-1048 |
| 9016606 | CIF | As0.5 Ca Cu H O5 P0.5 | P 21 21 21 | 7.328; 9.123; 5.769 90; 90; 90 | 385.677 | Schluter, J.; Pohl, D.; Gebhard, G. The new mineral hermannroseite, CaCu(PO4,AsO4)(OH), the phosphate analogue of conichalcite, from Tsumeb, Namibia Neues Jahrbuch fur Mineralogie, Abhandlungen, 2011, 188, 135-140 |
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