Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9014545 | CIF | C H K O3 | P 1 21/a 1 | 15.1725; 5.6283; 3.711 90; 104.631; 90 | 306.626 | 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 = 298 K Acta Crystallographica, Section B, 1974, 30, 1155-1166 |
| 9014547 | CIF | Fe1.22 H2 K Mg0.78 O12 Si4 | C 1 2 1 | 5.223; 9.047; 10.197 90; 100.43; 90 | 473.872 | Tsipurskij, S. I.; Drits, V. A. Refining the crystallographic structure of celadonite Mineralogiceskij Zhurnal, 1986, 8, 32-40 |
| 9014548 | CIF | Al1.458 Fe0.541 Mg1.001 O4 | F d -3 m :2 | 8.1697; 8.1697; 8.1697 90; 90; 90 | 545.278 | Princivalle, F.; Martignago, F.; Nestola, F.; Dal Negro, A. Kinetics of cation ordering in synthetic Mg(Al,Fe3+)2O4 spinels Note Sample F54, disordered at 1000 C for 24 h, then ordered at 650 C Annealing time = 21 min European Journal of Mineralogy, 2012, 24, 633-643 |
| 9014551 | CIF | Lu O6 Ta Ti | P b c n | 14.5288; 5.5226; 5.1572 90; 90; 90 | 413.797 | Thorogood, G. J.; Avdeev, M.; Kennedy, B. J. Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide Solid State Sciences, 2010, 12, 1263-1269 |
| 9014552 | CIF | Ba0.02 Ca3.78 Ce0.36 F2.98 Gd0.02 La0.12 Mn0.02 Na2.04 Nb0.14 Nd0.18 O15.02 Pr0.04 Si4 Sm0.02 Sr0.24 Ti0.85 Y0.06 Zr0.01 | P 1 21/c 1 | 7.424; 5.7083; 18.941 90; 101.424; 90 | 786.787 | Camara, F.; Sokolova, E.; Hawthorne, F. C. From structure topology to chemical composition. XII. Titanium silicates: the crystal chemistry of rinkite, Na2Ca4REETi(Si2O7)2OF3 Note: sample 3471 Mineralogical Magazine, 2011, 75, 2755-2774 |
| 9014557 | CIF | F2 Pb | F m -3 m | 5.9397; 5.9397; 5.9397 90; 90; 90 | 209.553 | Achary, S. N.; Tyagi, A. K. Synthesis and characterization of mixed fluorides with PbF2 and ScF3 Powder Diffraction, 2005, 20, 254-258 |
| 9014558 | CIF | Ca1.88 Fe1.91 H2 K0.54 Mg3.19 O24 Si8 | C 1 2/m 1 | 9.71; 17.833; 5.253 90; 105.85; 90 | 875.018 | Comopdi, P.; Boffa Ballaran, T.; Zanazzi, P. F.; Capalbo, C.; Zanetti, A.; Nazzareni, S. The effect of oxo-component on the high-pressure behavior of amphiboles Sample: DL5 P = 4.54 GPa American Mineralogist, 2010, 95, 1042-1051 |
| 9014559 | CIF | Cr2 Cu S4 | F d -3 m :1 | 9.82; 9.82; 9.82 90; 90; 90 | 946.966 | Riedel, E.; Horvath, E. Spinelle mit substituierten Nichtmetallteilgittern. IV. Roentgenographische Untersuchung der Systeme CuCr2(S11-xSex)4 und CuCr3(Se1-xTex)4 Zeitschrift fur Anorganische und Allgemeine Chemie, 1973, 399, 219-224 |
| 9014561 | CIF | Cs H4 Ni1.5 O26 Se2 U4 | C 1 2/c 1 | 8.755; 14.228; 17.927 90; 103.739; 90 | 2169.2 | Wylie, E. M.; Burns, P. C. Crystal structures of six new uranyl selenate and selenite compounds and their relationship with uranyl mineral structures Note: Compound 1 The Canadian Mineralogist, 2012, 50, 147-157 |
| 9014563 | CIF | C0.124 H3.224 Cr0.25 Mg0.75 O2.984 | P 63/m m c | 3.09689; 3.09689; 15.6193 90; 90; 120 | 129.731 | Mills, S. J.; Whitfield, P. S.; Wilson, S. A.; Woodhouse, J. N.; Dipple, G. M.; Raudsepp, M.; Francis, C. A. The crystal structure of stichtite, re-examination of barbertonite, and the nature of polytypism in MgCr hydrotalcites Note: Sample 84588, 2H1 polytype of stichtite American Mineralogist, 2011, 96, 179-187 |
| 9014567 | CIF | As2 Fe0.08 H7 Mg0.05 Mn0.05 O12 Zn2.82 | P n m a | 10.804; 19.003; 5.112 90; 90; 90 | 1049.54 | Neuhold, F.; Kolitsch, U.; Bernhardt, H. J.; Lengauer, C. L. Arsenohopeite, a new zinc arsenate mineral from the Tsumeb mine, Namibia Mineralogical Magazine, 2012, 76, 603-612 |
| 9014569 | CIF | C24 H48 Ca12 K7.11 O112 U8 | P n n m | 17.015; 18.048; 18.394 90; 90; 90 | 5648.55 | Hughes Kubatko, K. A.; Burns, P. C. The crystal structure of a novel uranyl tricarbonate, K2Ca3[(UO2)(CO3)3]2(H2O)6 The Canadian Mineralogist, 2004, 42, 997-1003 |
| 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 |
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