Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9014570 | CIF | Al7.08 B3 Ca0.62 F0.84 Fe0.66 H2.43 Li0.99 Mg0.24 Na0.32 O30.15 Si6 Ti0.03 | R 3 m :H | 15.894; 15.894; 7.115 90; 90; 120 | 1556.58 | Rozhdestvenskaya, I. V.; Bronzova, Y. M.; Frank-Kamenetskaya O V; Zolotarev, A. A.; Kuznetsova, L. G.; Bannova, I. I. Refinement of the crystal structure of calcium-lithium-aluminum tourmaline from the pegmatite vein in the Sangilen Upland (Tuva Republic) Crystallography Reports, 2008, 53, 223-227 |
| 9014571 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8361; 7.6155; 9.6392 90; 90.134; 90 | 355.004 | Rinaldi, R.; Gatta, G. D.; Angel, R. J. Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study American Mineralogist, 2010, 95, 1413-1421 |
| 9014572 | CIF | Cu Ni Sb2 | P -3 m 1 | 4.051; 4.051; 5.1382 90; 90; 120 | 73.024 | Kabalov, Y. K.; Sokolova, E. V.; Spiridonov, E. M.; Spiridonov, F. M. Crystal structure of a new mineral CuNiSb2 Doklady Akademii Nauk, 1994, 335, 709-711 |
| 9014576 | CIF | Al5.7 B3 Ca0.64 F0.46 H3.32 K0.02 Mg3.24 Na0.34 O30.54 Si6 V0.06 | R 3 m :H | 15.967; 15.967; 7.213 90; 90; 120 | 1592.55 | Schmetzer, K.; Nuber, B.; Abraham, K. Zur Kristallchemie Magnesium-reicher Turmaline Neues Jahrbuch fur Mineralogie, Abhandlungen, 1979, 136, 93-112 |
| 9014578 | CIF | Cl H | F m -3 m | 5.482; 5.482; 5.482 90; 90; 90 | 164.747 | Sandor, E.; Farrow, R. F. C. Crystal structure of solid hydrogen chloride and deuterium chloride Note T = 118.5 K Nature, 1967, 213, 171-172 |
| 9014579 | CIF | Al6.454 As0.21 B H O17.64 Sb0.36 Si2.43 Ta0.258 | P n m a | 4.695; 11.906; 20.38 90; 90; 90 | 1139.21 | Kazantsev, S. S.; Pushcharovsky, D. Y.; Pasero, M.; Merlino, S.; Zubkova, N. V.; Kabalov, Y. K.; Voloshin, A. V. Crystal structure of holtite I Crystallography Reports, 2005, 50, 42-47 |
| 9014580 | CIF | Cu O | C 1 2/c 1 | 4.6837; 3.4226; 5.1288 90; 99.54; 90 | 81.08 | Asbrink, S.; Norrby, L. J. A refinement of the crystal structure of copper(II) oxide, with a discussion of some exceptional E.s.d.'s Acta Crystallographica, Section B, 1970, 26, 8-15 |
| 9014581 | CIF | Ba0.5 Cu O10 Si4 Sr0.5 | P 4/n c c :2 | 7.39447; 7.39447; 15.8534 90; 90; 90 | 866.835 | Knight, K. S.; Henderson, C. M. B. Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 200 K European Journal of Mineralogy, 2007, 19, 189-200 |
| 9014583 | CIF | Al5.466 B3 Ca0.03 Fe3.534 Na0.97 O31 Si6 | R 3 m :H | 15.917; 15.917; 7.252 90; 90; 120 | 1591.15 | Ertl, A.; Kolitsch, U.; Dyar, M. D.; Hughes, J. M.; Rossman, G. R.; Pieczka, A.; Henry, D. J.; Pezzotta, F.; Prowatke, S.; Lengauer, C. L.; Korner, W.; Brandstatter, F.; Francis, C. A.; Prem, M.; Tillmanns, E. Limitations of Fe2+ and Mn2+ site occupancy in tourmaline: Evidence from Fe2+ - and Mn2+ -rich tourmaline Note: sample bls2h1, heated in air at 700 C for 10 h American Mineralogist, 2012, 97, 1402-1416 |
| 9014584 | CIF | Al0.06 Ba0.97 Ca0.04 Fe2.7 H3 Mg0.04 Mn1.14 Na0.02 O15 P3 Sr0.03 | P 1 21/m 1 | 9.2425; 12.47; 5.002 90; 100.19; 90 | 567.407 | Elliott, P.; Willis, A. C. The crystal structure of perloffite Mineralogical Magazine, 2011, 75, 317-325 |
| 9014585 | CIF | Cu0.881 H12.248 O18.124 P2 U2 | P 4/n :2 | 6.9551; 6.9551; 16.6604 90; 90; 90 | 805.92 | Stubbs, J. E.; Post, J. E.; Elbert, D. C.; Heaney, P. J.; Veblen, D. R. Uranyl phosphate sheet reconstruction during dehydration of metatorbernite [Cu(UO2)2(PO4)2*8H2O] Note: This is the 8.3 Angstrom phase while heating at 129 C American Mineralogist, 2010, 95, 1132-1140 |
| 9014586 | CIF | K3 Mo4 O22 P4 | P 1 21/c 1 | 9.721; 9.805; 12.329 90; 128.73; 90 | 916.723 | Guesdon, A.; Borel, M.; Leclaire, A.; Grandin, A.; Raveau, B. A series of Mixed-valent Molybdenum Monophosphates, Isotypic with Leucophosphite Represented by CsMo2P2O10 and K1.5Mo2P2O10.H2O _cod_database_code 1001554 Zeitschrift fur Anorganische und Allgemeine Chemie, 1993, 619, 1841-1849 |
| 9014587 | CIF | Fe S4 Sb2 | P n a m | 10.9015; 13.3136; 3.69 90; 90; 90 | 535.56 | Periotto, B.; Balic-Zunic T; Nestola, F. The role of the Sb3+ lone-electron pairs and Fe2+ coordination in the high-pressure behavior of berthierite Note: P = 7.41 GPa the Baia Mare metallogenic area, Romania The Canadian Mineralogist, 2012, 50, 201-218 |
| 9014588 | CIF | Al2 Co0.63 Mg0.37 O4 | F d -3 m :2 | 8.0957; 8.0957; 8.0957 90; 90; 90 | 530.595 | Bosi, F.; Halenius, U.; D'Ippolito V; Andreozzi, G. B. Blue spinel crystals in the MgAl2O4-CoAl2O4 series: Part II. Cation ordering over short-range and long-range scales Sample: CoAl50 American Mineralogist, 2012, 97, 1834-1840 |
| 9014591 | CIF | Fe | F m -3 m | 3.583; 3.583; 3.583 90; 90; 90 | 45.998 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 8.36 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014592 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8356; 7.6114; 9.6341 90; 90.158; 90 | 354.588 | Rinaldi, R.; Gatta, G. D.; Angel, R. J. Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study American Mineralogist, 2010, 95, 1413-1421 |
| 9014594 | CIF | Cr2 O3 | R -3 c :H | 4.756; 4.756; 13.109 90; 90; 120 | 256.793 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 35.4 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 9014595 | CIF | Ca2 O4 Si | P b n m | 5.081; 11.224; 6.778 90; 90; 90 | 386.544 | Udagawa, S.; Urabe, K.; Natsume, M.; Yano, T. Refinement of the crystal structure of gamma-Ca2SiO4 Cement and Concrete Research, 1980, 10, 139-144 |
| 9014596 | CIF | Al7.272 B3 Ca0.614 F0.633 Fe0.156 H3.367 Li1.482 Mg0.018 Mn0.057 Na0.311 O30.367 Pb0.006 Si6 Ti0.018 | R 3 m :H | 15.8333; 15.8333; 7.1025 90; 90; 120 | 1542 | Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S. Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L27, ordered model The Canadian Mineralogist, 2011, 49, 63-88 |
| 9014598 | CIF | Ca0.58 Fe0.5 Mg0.5 Na0.42 O6 Si2 | C 1 2/c 1 | 9.663; 8.813; 5.2184 90; 106.4; 90 | 426.318 | Mills, S. J.; Groat, L. A. The crystal structure of yellow aegirine-augite from Mount Anakie, Victoria Australian Journal of Mineralogy, 2008, 14, 43-45 |
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