Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9016278 | CIF | Al0.32 O2 Si0.68 | R -3 m :R | 9.4; 9.4; 9.4 94.3; 94.3; 94.3 | 823.197 | Dent, L. S.; Smith, J. V. Crystal structure of chabazite, a molecular sieve Note: extra-framework cations not located Nature, 1958, 181, 1794-1796 |
| 9016283 | CIF | Ca5 O12 P3 S0.5 | P -3 | 9.4619; 9.4619; 6.8342 90; 90; 120 | 529.877 | Henning, P. A.; Adolfsson, E.; Grins, J. The chalcogenide phosphate apatites Ca10(PO4)6S, Sr10(PO4)6S, Ba10(PO4)6S and Ca10(PO4)6Se Zeitschrift fur Kristallographie, 2000, 215, 226-230 |
| 9016284 | CIF | Ca5.1 H3.92 Na3.62 O43.96 Si16 | P -1 | 9.576; 9.577; 16.438 85.85; 75.23; 60.142 | 1261.54 | Yakovenchuk, V. N.; Ivanyuk, G. Y.; Pakhomovsky, Y. A.; Selivanova, E. A.; Mikhailova, J. A.; Krivovichev, S. V.; Zolotarev, A. A.; Zalkind, O. A. Ellingsenite, Na5Ca6Si18O38(OH)13*6H2O, a new martinite-related mineral species from phonolite of the Aris alkaline complex, Namibia Note: This is reported as an incomplete structure The Canadian Mineralogist, 2011, 49, 1165-1173 |
| 9016285 | CIF | H5 O15 Si4 Sr3 Ti | P 1 21/m 1 | 10.958; 7.778; 7.799 90; 100.9; 90 | 652.727 | Mizota, T.; Komatsu, M.; Chihara, K. On the crystal structure of Sr3TiSi4O12(OH)*2H2O, a new mineral Note: paper is missing data for O8 Mineralogical Journal, 1973, 7, 302-305 |
| 9016286 | CIF | As3 Co | I m -3 | 8.2055; 8.2055; 8.2055 90; 90; 90 | 552.478 | Kjekshus, A.; Rakke, T. Compounds with the skutterudite type crystal structure. III. Structural data for arsenides and antimonides, Acta Chemica Scandinavica A, 1974, 28, 99-103 |
| 9016287 | CIF | Ca3 Mg4 O24 S6 | P 63 | 16.581; 16.581; 7.348 90; 90; 120 | 1749.53 | Krivovichev, S. V.; Shcherbakova, E. P.; Nishanbaev, T. P. The crystal structure of beta-CaMg2(SO4)3, a mineral phase from coal dumps of the Chelyabinsk coal basin, Russia The Canadian Mineralogist, 2010, 48, 1469-1475 |
| 9016288 | CIF | C1.38 H11.58 Ba0.27 Ca17.1 Ce3.06 Cl0.93 Fe6.3 Hf0.18 K4.32 Mn9.3 Na39.02 Nb2.34 O270.63 Si86.85 Sr3.15 Zr8.82 | R 3 m :H | 14.281; 14.281; 30.243 90; 90; 120 | 5341.62 | Rastsvetaeva, R. K.; Rozenberg, K. A.; Khomyakov, A. P. Crystal structure of a K analogue of Kentbrooksite Doklady Chemistry, 2005, 403, 148-151 |
| 9016289 | CIF | Fe1.1 Mg0.75 Mn0.15 O4 Si | P b n m | 4.838; 10.49; 6.136 90; 90; 90 | 311.406 | Hazen, R. M. Effects of temperature and pressure on the crystal structure of ferromagnesian olivine T = 900 deg C,P = 1 atm American Mineralogist, 1977, 62, 286-295 |
| 9016290 | CIF | Cd0.002 Cu0.005 Fe0.023 In0.002 S Zn0.968 | F -4 3 m | 5.4159; 5.4159; 5.4159 90; 90; 90 | 158.859 | Nitta, E.; Kimata, M.; Hoshino, M.; Echigo, T.; Hamasaki, S.; Nishida, N.; Shimizu, M.; Akasak, T. Crystal chemistry of ZnS minerals formed as high-temperature volcanic sublimates: matraite identical with sphalerite Journal of Mineralogical and Petrological Sciences, 2008, 103, 145-151 |
| 9016292 | CIF | Fe0.07 Mn0.18 Nb0.42 O4 Sc0.5 Sn0.2 Ta0.58 Ti0.05 | P 1 2/c 1 | 4.784; 5.693; 5.12 90; 91.15; 90 | 139.417 | Kolitsch, U.; Kristiansen, R.; Raade, G.; Tillmanns, E. Heftetjernite, a new scandium mineral from the Heftetjern pegmatite, Tordal, Norway European Journal of Mineralogy, 2010, 22, 309-316 |
| 9016293 | CIF | Fe0.999 Nb0.13 O6 Ta1.871 | P 42/m n m | 4.7547; 4.7547; 9.2893 90; 90; 90 | 210.005 | Zema, M.; Tarantino, S. C.; Giorgiani, A. Structural changes induced by cation ordering in ferrotapiolite Note: Crystal Kim20_q1, treated at 600 C for 5 min Mineralogical Magazine, 2006, 70, 319-328 |
| 9016294 | CIF | As0.04 B3 Ca2.53 F14 Fe0.83 Mn0.93 Na1.17 Nd7.53 O34 P0.7 Pb0.03 Si6.26 Th0.09 Ti0.02 Y3.72 | R 3 m :H | 10.7527; 10.7527; 27.4002 90; 90; 120 | 2743.59 | Raade, G.; Grice, J. D.; Erambert, M.; Kristiansson, P.; Witzke, T. Proshchenkoite-(Y) from Russia - a new mineral species in the vicanite group: Descriptive data and crystal structure Mineralogical Magazine, 2008, 72, 1071-1082 |
| 9016295 | CIF | Na5 O15 P3 V2 | C 1 m 1 | 6.3089; 20.10379; 5.1172 90; 91.134; 90 | 648.902 | Le Bail, A. On the structure of Na5V2P3O14*(H2O) _cod_database_code 1000145 Journal of Solid State Chemistry, 1993, 102, 281-282 |
| 9016296 | CIF | As3 Ba0.108 Fe4 H11.96 K0.138 Na0.75 O19.98 | P -4 3 m | 7.928; 7.928; 7.928 90; 90; 90 | 498.3 | Hager, S. L.; Leverett, P.; Williams, P. A.; Mills, S. J.; Hibbs, D. E.; Raudsepp, M.; Kampf, A. R.; Birch, W. D. The single-crystal X-ray structures of bariopharmacosiderite-C, bariopharmacosiderite-Q and natropharmacosiderite The Canadian Mineralogist, 2010, 48, 1477-1485 |
| 9016297 | CIF | Be O | P 63 m c | 2.6832; 2.6832; 4.3524 90; 90; 120 | 27.137 | Hazen, R. M.; Finger, L. W. High-pressure and high-temperature crystal chemistry of beryllium oxide Note: P = 3.8 GPa Journal of Applied Physics, 1986, 59, 3728-3733 |
| 9016300 | CIF | Al4 Ca0.725 H1.98 Li0.105 Mg0.105 Na0.21 O12 Si2 | C 1 c 1 | 5.108; 8.844; 19.156 90; 95.48; 90 | 861.42 | Joswig, W.; Takeuchi, Y.; Fuess, H. Neutron-diffraction study on the orientation of hydroxyl groups in margarite Zeitschrift fur Kristallographie, 1983, 165, 295-303 |
| 9016301 | CIF | Fe O4 Sb2 | P 1 21/c 1 | 5.7792; 8.3134; 8.4545 90; 91.879; 90 | 405.976 | Hinrichsen, B.; Dinnebier, R. E.; Rajiv, P.; Hanfland, M.; Grzechnik, A.; Jansen, M. Advances in data reduction of high-pressure X-ray powder diffraction data from two-dimensional detectors: a case study of schafarzikite (FeSb2O4) Note: P = 4.2 GPa, this is denoted as Phase II Journal of Physics: Condensed Matter, 2006, 18, S1021-S1037 |
| 9016303 | CIF | H6 Mg3.864 O19 Si6 | P n c n | 13.3317; 27.049; 5.2694 90; 90; 90 | 1900.19 | Sanchez, M.; Garcia-Romero E; Suarez, M.; Silva, I.; Fuentes-Montero L; Martinez-Criado G Variability in sepiolite: Diffraction studies Note: Sample GRA225 Note: T = 225 C American Mineralogist, 2011, 96, 1443-1454 |
| 9016304 | CIF | C H K O3 | P 1 21/a 1 | 15.1538; 5.6186; 3.6868 90; 104.356; 90 | 304.104 | Thomas, J. O.; Tellgren, R.; Olovsson, I. Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 219 K Acta Crystallographica, Section B, 1974, 30, 1155-1166 |
| 9016306 | CIF | Al3.6 H20.8 O34.4 Si8.4 Sr2.03 | R -3 m :R | 9.416; 9.416; 9.416 93.87; 93.87; 93.87 | 828.85 | Alberti, A.; Galli, E.; Vezzalini, G.; Passaglia, E.; Zanazzi, P. F. Position of cations and water molecules in hydrated chabazite. Natural and Na-, Ca-, Sr- and K-exchanged chabazites Note: Sr-exchanged Zeolites, 1982, 2, 303-309 |
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