Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9015863 | CIF | Pd Sb2 | P a -3 | 6.4584; 6.4584; 6.4584 90; 90; 90 | 269.386 | Furuseth, S.; Selte, K.; Kjekshus, A. Redetermined crystal structures of PdAs2, PdSb2, PtP2, PtAs2, PtSb2, alpha-PtBi2, and AuSb2 Acta Chemica Scandinavica, 1965, 19, 735-741 |
| 9015866 | CIF | Al3.6 H20.04 K3.02 Na0.44 O34.02 Si8.4 | R -3 m :R | 9.442; 9.442; 9.442 94.29; 94.29; 94.29 | 834.316 | 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: K-exchanged Zeolites, 1982, 2, 303-309 |
| 9015868 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8355; 7.6085; 9.6326 90; 90.159; 90 | 354.391 | Rinaldi, R.; Gatta, G. D.; Angel, R. J. Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study Note: T = 280 K American Mineralogist, 2010, 95, 1413-1421 |
| 9015869 | CIF | Cr0.5 H12 O21.5 Pb5 Te3 | C 2 2 21 | 9.6646; 19.4962; 10.5101 90; 90; 90 | 1980.34 | Kampf, A. R.; Mills, S. J.; Housley, R. M.; Rumsey, M. S.; Spratt, J. Lead-tellurium oxysalts from Otto Mountain near Baker, California: VII. Chromschieffelinite, Pb10Te6O20(OH)14(CrO4)(H2O)5, the chromate analog of schieffelinite American Mineralogist, 2012, 97, 212-219 |
| 9015870 | CIF | Cu2 O7 V2 | P 1 | 7.8468; 5.6213; 10.18 103.61; 109.71; 45.74 | 302.746 | Yashima, M.; Suzuki, R. O. Electronic structure and magnetic properties of monoclinic beta-Cu2V2O7: A GGA+U study Note: theoretical study, in a triclinic setting Physical Review B, 2009, 79, 125201-125206 |
| 9015871 | CIF | B H O2 | P 1 21/a 1 | 7.122; 8.842; 6.771 90; 93.26; 90 | 425.698 | Zachariasen, W. H. The crystal structure of monoclinic metaboric acid Acta Crystallographica, 1963, 16, 385-389 |
| 9015875 | CIF | C0.704 H2 Al2.28 Na3.702 O15.112 Si3.72 | P 63 m c | 12.584; 12.584; 5.101 90; 90; 120 | 699.557 | Pekov, I. V.; Olysych, L. V.; Chukanov, N. V.; Zubkova, N. V.; Pushcharovsky D Yu; Van, K. V.; Giester, G.; Tillmanns, E. Crystal chemistry of cancrinite-group minerals with an AB-type framework: A review and new data. I. Chemical and structural variations Note: Sample# u1631 The Canadian Mineralogist, 2012, 49, 1129-1150 |
| 9015879 | CIF | Al1.36 Ba0.03 F0.16 Fe0.806 H1.35 K0.89 Mg2.194 Na0.08 O11.84 Si2.64 | C 1 2/m 1 | 5.32568; 9.2207; 10.2093 90; 100.014; 90 | 493.705 | Zema, M.; Ventruti, G.; Lacalamita, M.; Scordari, F. Kinetics of Fe-oxidation/deprotonation process in Fe-rich phlogopite under isothermal conditions Sample: SA1_18n American Mineralogist, 2010, 95, 1458-1466 |
| 9015880 | CIF | Fe3 H14 O16 P2 | P -1 | 7.989; 9.321; 4.629 97.34; 95.96; 108.59 | 320.184 | Chukanov, N. V.; Scholz, R.; Aksenov, S. M.; Rastsvetaeva, R. K.; Pekov, I. V.; Belakovskiy, D. I.; Krambrock, K.; Paniago, R. M.; Righi, A.; Martins, R. F.; Belotti, F. M.; Bermanec, V. Metavivianite, Fe2+Fe3+2(PO4)2(OH)2*6H2O: new data and formula revision Mineralogical Magazine, 2012, 76, 725-741 |
| 9015882 | CIF | Al2.15 Ca2 Fe0.12 H Mn0.73 O13 Si3 | P 1 21/m 1 | 8.8727; 5.6686; 10.1682 90; 115.48; 90 | 461.675 | Nagashima, M.; Akasada, M. X-ray Rietveld and 57Fe Mossbauer studies of epidote and piemontite on the join Ca2Al2FeSi3O12(OH) - Ca2Al2MnSi3O12(OH) formed by hydrothermal synthesis Sample: q=0.25, run 30 American Mineralogist, 2010, 95, 1237-1246 |
| 9015884 | CIF | Al0.08 Ca2 Fe1.513 H Mg0.197 Mn0.21 O15 Si5 | P -1 | 7.469; 12.161; 6.675 86.09; 93.94; 112.21 | 559.398 | Armbruster, T. Cation distribution in Mg, Mn-bearing babingtonite from Arvigo, Val Calanca, Grisons, Switzerland Note: Sample Arvigo 1, NMBE 34973 Schweizerische Mineralogische und Petrographische Mitteilungen, 2000, 80, 279-284 |
| 9015885 | CIF | C Fe O3 | R -3 c :H | 4.348; 4.348; 12.52 90; 90; 120 | 204.981 | Lavina, B.; Dera, P.; Downs, R. T.; Yang, W.; Sinogeikin, S.; Meng, Y.; Shen, G.; Schiferl, D. Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition Note: run P27-3, P = 55.0 GPa Physical Review B, 2010, 82, 064110-064118 |
| 9015886 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9723; 7.9983; 5.7931 90; 90; 90 | 230.391 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 527 K American Mineralogist, 2012, 97, 707-712 |
| 9015887 | CIF | Cu O | C 1 2/c 1 | 4.6839; 3.4734; 5.1226 90; 98.73; 90 | 82.374 | Calos, N. J.; Forrester, J. S.; Schaffer, G. B. A crystallographic contribution to the mechanism of a mechanically induced solid state reaction Note: milling time = 25 min Journal of Solid State Chemistry, 1996, 122, 273-280 |
| 9015889 | CIF | Ca Cl2 H8 O4 | P -1 | 6.5932; 6.3673; 8.5606 97.83; 93.5; 110.58 | 331.003 | Leclaire, A.; Borel, M. M. Liaisons hydrogene et coordination du calcium dans les cristaux de CaCl2*4H2O alpha Acta Crystallographica, Section B, 1979, 35, 585-588 |
| 9015890 | CIF | Al7.188 B3 Ca0.628 F0.702 Fe0.021 H5.97 Li1.584 Mn0.207 Na0.297 O32.97 Pb0.023 Si6 | R 3 m :H | 15.8456; 15.8456; 7.1066 90; 90; 120 | 1545.29 | 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: L5, disordered model The Canadian Mineralogist, 2011, 49, 63-88 |
| 9015893 | CIF | C Ca O3 | P m c n | 4.9566; 7.9808; 5.7464 90; 90; 90 | 227.314 | Antao, S. M.; Hassan, I. Temperature dependence of the structural parameters in the transformation of aragonite to calcite, as determined from in situ synchrotron powder X-ray-diffraction data Note: T = 50 C Note: P = 101 kPa The Canadian Mineralogist, 2010, 48, 1225-1236 |
| 9015895 | CIF | Ca6 H2 O13 Si3 | P -1 | 6.8155; 6.9363; 12.8904 90.652; 97.659; 98.195 | 597.495 | Armbruster, T.; Lazic, B.; Gfeller, F.; Galuskin, E. V.; Galuskina, I. O.; Savelyeva, V. B.; Zadov, A. E.; Pertsev, N. N.; Dzierzanowski, P. Chlorine content and crystal chemistry of dellaite from the Birkhin gabbro massif, Eastern Siberia, Russia Note: Cl-free dellaite Mineralogical Magazine, 2011, 75, 379-394 |
| 9015897 | CIF | La0.924 Nb1.228 O6 Ti0.772 | P n m a | 10.96305; 7.58996; 5.46833 90; 90; 90 | 455.015 | Golobic, A.; Skapin, S. D.; Suvorov, D.; Meden, A. Solving Structural Problems of Ceramic Materials Croatica Chemica Acta, 2004, 77, 435-446 |
| 9015898 | CIF | C Ca O3 | P 63/m m c | 4.1304; 4.1304; 8.4749 90; 90; 120 | 125.213 | Le Bail, A.; Ouhenia, S.; Chateigner, D. Microtwinning hypothesis for a more ordered vaterite model Note: Kamhi (1963) model, not preferred Powder Diffraction, 2011, 26, 16-21 |
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