Crystallography Open Database

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COD ID	Links	Formula	Space group	Cell parameters	Cell volume	Bibliography
9016019	CIF	Ca1.88 Fe1.91 H2 K0.54 Mg3.19 O24 Si8	C 1 2/m 1	9.841; 18.019; 5.307 90; 105.33; 90	907.58	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 = 0.67 GPa American Mineralogist, 2010, 95, 1042-1051
9016020	CIF	C Ca O3	R -3 c :H	4.9767; 4.9767; 17.361 90; 90; 120	372.382	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 = 578 C Note: P = 101 kPa The Canadian Mineralogist, 2010, 48, 1225-1236
9016021	CIF	Al1.455 Fe0.545 Mg O4	F d -3 m :2	8.1706; 8.1706; 8.1706 90; 90; 90	545.459	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 750 C Annealing time = 17,520 min European Journal of Mineralogy, 2012, 24, 633-643
9016022	CIF	C Ca O3	R -3 c :H	4.99026; 4.99026; 17.0684 90; 90; 120	368.103	Sitepu, H. Texture and structural refinement using neutron diffraction data from molybdite (MoO3) and calcite (CaCO3) powders and a Ni-rich Ni50.7Ti49.30 alloy Note: Generalized spherical-harmonic model Powder Diffraction, 2009, 24, 315-326
9016025	CIF	Fe	F m -3 m	3.475; 3.475; 3.475 90; 90; 90	41.963	Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M622, P = 24.37 GPa, T = 1073 K American Mineralogist, 2012, 97, 1417-1420

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