Crystallography Open Database

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COD ID	Links	Formula	Space group	Cell parameters	Cell volume	Bibliography
9015967	CIF	Cr H2 O2	P n n m	4.8623; 4.2972; 2.9567 90; 90; 90	61.778	Jahn, S.; Wunder, B.; Koch-Muller M; Tarrieu, L.; Pohle, M.; Watenphul, A.; Taran, M. N. Pressure-induced hydrogen bond symmetrisation in guyanaite, B-CrOOH: evidence from spectroscopy and ab initio simulations Sample: Run LT9 European Journal of Mineralogy, 2012, 24, 839-850
9015968	CIF	B Nd O5 Si	P 31 2 1	6.8035; 6.8035; 6.6487 90; 90; 120	266.521	Shi, Y.; Liang, J. K.; Zhang, H.; Yang, J. L.; Zhuang, W. D.; Rao, G. H. Crystal structure and vibrational spectra studies of stillwellite compounds NdBSiO5 Journal of Alloys and Compounds, 1997, 259, 163-169
9015969	CIF	C Ca O3	P m c n	4.9644; 8.0057; 5.7805 90; 90; 90	229.737	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 = 218 C Note: P = 101 kPa The Canadian Mineralogist, 2010, 48, 1225-1236
9015970	CIF	Al2.73 Ba0.01 H2.86 K0.465 N0.36 Na0.03 O11.236 Si3.128	C 1 2/c 1	9.027; 5.1999; 20.616 90; 100.113; 90	952.67	Mesto, E.; Scordari, F.; Lacalamita, M.; Schingaro, E. Tobelite and NH4+ -rich muscovite single crystals from Ordovician Armorican sandstones (Brittany, France): Structure and crystal chemistry Note: sample musc_4 American Mineralogist, 2012, 97, 1460-1468
9015971	CIF	Al1.608 Fe0.389 Mg1.001 O4	F d -3 m :2	8.1477; 8.1477; 8.1477 90; 90; 90	540.885	Princivalle, F.; Martignago, F.; Nestola, F.; Dal Negro, A. Kinetics of cation ordering in synthetic Mg(Al,Fe3+)2O4 spinels Note Sample F39, disordered at 1000 C for 24 h, then ordered at 750 C Annealing time = 240 min European Journal of Mineralogy, 2012, 24, 633-643

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