Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9015614 | CIF | Fe0.999 Nb0.13 O6 Ta1.871 | P 42/m n m | 4.7497; 4.7497; 9.253 90; 90; 90 | 208.744 | Zema, M.; Tarantino, S. C.; Giorgiani, A. Structural changes induced by cation ordering in ferrotapiolite Note: Crystal Kim9_q2, treated at 750 C for 120 min Mineralogical Magazine, 2006, 70, 319-328 |
| 9015615 | CIF | Bi2 Pb3 S6 | B b m m | 13.28; 20.26; 4.0448 90; 90; 90 | 1088.27 | Olsen, L. A.; Balic Zunic, T.; Makovicky, E. High-pressure anisotropic distortion of Pb3Bi2S6: a pressure-induced, reversible phase transition with migration of chemical bonds Note: P = 2.90 GPa Note: occupancies not refined Inorganic Chemistry, 2008, 47, 6756-6762 |
| 9015616 | CIF | Ba O3 Ti | R 3 m :R | 4.0035; 4.0035; 4.0035 89.843; 89.843; 89.843 | 64.167 | Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 40 K Journal of Physical Chemistry, 1993, 97, 2368-2377 |
| 9015620 | CIF | Al2 O4 Zn | F d -3 m :2 | 8.08514; 8.08514; 8.08514 90; 90; 90 | 528.521 | Ardit, M.; Cruciani, G.; Dondi, M. Structural relaxation in tetrahedrally coordinated Co2+ along the gahnite-Co-aluminate spinel solid solution Note: inversion parameter = 0.000, Co content = 0.00 apfu American Mineralogist, 2012, 97, 1394-1401 |
| 9015621 | CIF | B7 Cl Fe3 O13 | R 3 c :H | 8.6231; 8.6231; 21.0503 90; 90; 120 | 1355.55 | Mendoza-Alvarez M E; Yvon, K.; Depmeier, W.; Schmid, H. Structure refinement of trigonal iron-chlorine boracite Acta Crystallographica, Section C, 1985, 41, 1551-1552 |
| 9015622 | CIF | Ca5 H18 O32 Si9 | P -1 | 9.69; 7.28; 22.02 92.7; 100.1; 110.9 | 1418.48 | Merlino, S. Okenite, Ca10Si18O46*18H2O: the first example of a chain and sheet silicate American Mineralogist, 1983, 68, 614-622 |
| 9015623 | CIF | Al3 K O12 Si3 | C 1 2/c 1 | 5.189; 8.995; 20.09698 90; 95.18; 90 | 934.197 | Gatineau, L. Localisation des remplacements isomorphiques dans la muscovite Note: polytype Muscovite 2M1 _cod_database_code 1000042 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1963, 256, 4648-4649 |
| 9015624 | CIF | Al2.916 H6.117 K0.876 Na0.071 O14.039 S2 | R -3 m :H | 6.9806; 6.9806; 17.425 90; 90; 120 | 735.341 | Zema, M.; Callegari, A. M.; Tarantino, S. C.; Gasparini, E.; Ghigna, P. Thermal expansion of alunite up to dehydroxylation and collapse of the crystal structure Note: T = 200 C Mineralogical Magazine, 2012, 76, 613-623 |
| 9015625 | CIF | Bi6.188 Cd0.812 In0.208 Pb3.792 S13.539 Se0.461 | P 1 21/m 1 | 15.4172; 4.0582; 20.8071 90; 98.031; 90 | 1289.05 | Borisov, S. V.; Pervukhina, N. V.; Magarill, S. A.; Kuratieva, N. V.; Bryzgalov, I. A.; Mozgova, N. N.; Chaplygin, I. V. The crystal structure of (Cd,In)-rich cannizzarite from Kudriavy Volcano, Iturup Island, Kuriles, Russia The Canadian Mineralogist, 2012, 50, 387-395 |
| 9015626 | CIF | Al2 Co0.07 Mg0.93 O4 | F d -3 m :2 | 8.0851; 8.0851; 8.0851 90; 90; 90 | 528.514 | 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: CoAl0.5 American Mineralogist, 2012, 97, 1834-1840 |
| 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 |
| 9015631 | CIF | Ag1.041 Mn0.919 Pb3 S12 Sb5.041 | P 1 21/n 1 | 19.3462; 12.7251; 8.7472 90; 90.017; 90 | 2153.41 | Yang, H.; Downs, R. T.; Evans, S. H.; Feinglos, M. N.; Tait, K. T. Crystal structure of uchucchacuaite, AgMnPb3Sb5S12, and its relationship with ramdohrite and fizelyite Note: Sample ID R070760 American Mineralogist, 2011, 96, 1186-1189 |
| 9015634 | CIF | Al4 F4 H4 K0.65 Li0.672 Mn1.35 O16 Si4 | C c c a :2 | 13.715; 20.302; 5.138 90; 90; 90 | 1430.64 | Ghose, S.; Sen Gupta, P. K.; Boggs, R. C.; Schlemper, E. O. Crystal chemistry of a nonstoichiometric carpholite, Kx(Mn2-x,Lix)Al4Si4O12(OH)4F4: A chain silicate related to pyroxenes American Mineralogist, 1989, 74, 1084-1090 |
| 9015636 | CIF | Cu Fe S2 | I -4 2 d | 5.28563; 5.28563; 10.41917 90; 90; 90 | 291.09 | Knight, K. S.; Marshall, W. G.; Zochowski, S. W. The low-temperature and high-pressure thermoelastic and structural properties of chalcopyrite, CuFeS2 T = 4.2 K The Canadian Mineralogist, 2011, 49, 1015-1034 |
| 9015638 | CIF | B2 Mn | P 6/m m m | 3.007; 3.007; 3.037 90; 90; 120 | 23.782 | Aronsson, B. A note on the compositions and crystal structures of MnB2, Mn3Si, Mn5Si3 and FeSi2 Acta Chemica Scandinavica, 1960, 14, 1414-1418 |
| 9015640 | CIF | Fe Mn O4 Si | P b n m | 4.86184; 10.58358; 6.1695 90; 90; 90 | 317.456 | Redfern, S. A. T.; Knight, K. S.; Henderson, C. M. B.; Wood, B. J. Fe-Mn cation ordering in fayalite-tephroite (FexMn1-x)2SiO4 olivines: A neutron diffraction study Mineralogical Magazine, 1998, 62, 607-615 |
| 9015642 | CIF | As Cu3 S4 | P m n 21 | 7.4127; 6.4404; 6.1577 90; 90; 90 | 293.973 | Karanovic, L.; Cvetkovic, L.; Poleti, D.; Balic-Zunic T; Makovicky, E. Crystal and absolute structure of enargite from Bor (Serbia) Neues Jahrbuch fur Mineralogie, Monatshefte, 2002, 2002, 241-253 |
| 9015643 | CIF | Mg0.096 O1.904 Zr0.904 | F m -3 m | 5.0858; 5.0858; 5.0858 90; 90; 90 | 131.546 | Howard, C. J.; Hill, R. J.; Reichert, B. E. Structures of the ZrO2 polymorphs at room temperature by high-resolution neutron powder diffraction Note: model 1, O atom not displaced Acta Crystallographica, Section B, 1988, 44, 116-120 |
| 9015646 | CIF | Al7.452 B3.336 Be0.012 Ca0.145 Fe1.203 H6.19 Li0.189 Mg0.087 Mn0.024 Na0.632 O31 Si5.526 Ti0.027 | R 3 m :H | 15.9013; 15.9013; 7.1213 90; 90; 120 | 1559.39 | Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F. Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T5 American Mineralogist, 2004, 89, 447-454 |
| 9015647 | CIF | Al1.46 Fe0.539 Mg1.001 O4 | F d -3 m :2 | 8.1687; 8.1687; 8.1687 90; 90; 90 | 545.078 | 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 550 C Annealing time = 11,100 min European Journal of Mineralogy, 2012, 24, 633-643 |
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