Crystallography Open Database

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COD ID	Links	Formula	Space group	Cell parameters	Cell volume	Bibliography
9014857	CIF	H6 Mg O6 Si	P 21 21 21	4.976; 5.023; 7.115 90; 89.89; 90	177.835	Wunder, B.; Jahn, S.; Koch-Muller M; Speziale, S. The 3.65 A phase, MgSi(OH)6: structural insights from DFT-calculations and T-dependent IR spectroscopy Note: theoretical structure, LDA from P2_12_12_1 American Mineralogist, 2012, 97, 1043-1048
9014858	CIF	Be O	P 63 m c	2.6983; 2.6983; 4.3776 90; 90; 120	27.602	Hazen, R. M.; Finger, L. W. High-pressure and high-temperature crystal chemistry of beryllium oxide Note: Crystal no. 2 in air Journal of Applied Physics, 1986, 59, 3728-3733
9014859	CIF	Fe0.85 Mg0.49 Mn1.66 O8 P2	P 1 21/c 1	6.088; 4.814; 10.484 90; 89.42; 90	307.245	Hatert, F.; Roda-Robles E; de Parseval, P.; Wouters, J. Zavaliaite, (Mn2+,Fe2+,Mg)3(PO4)2, a new member of the sarcopside group from La Empleada pegmatite, San Luis Province, Argentina The Canadian Mineralogist, 2012, 50, 1445-1452
9014860	CIF	Mg O3 Si	P b c a	18.158; 8.78; 5.1574 90; 90; 90	822.23	Periotto, B.; Balic-Zunic T; Nestola, F.; Katerinopoulou, A.; Angel, R. J. Re-investigation of the crystal structure of enstatite under high-pressure conditions Note: P = 1.23(4) GPa American Mineralogist, 2012, 97, 1741-1748
9014863	CIF	Al2 Mg3 O12 Si3	I a -3 d	11.473; 11.473; 11.473 90; 90; 90	1510.19	Nakatsuka, A.; Shimokawa, M.; Nakayama, N.; Ohtaka, O.; Arima, H.; Okube, M.; Yoshiasa, A. Static disorders of atoms and experimental determination of Debye temperature in pyrope: Low- and high-temperature single-crystal X-ray diffraction study Note: T = 472.6 K American Mineralogist, 2011, 96, 1593-1605

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