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Kristallstruktur und Infrarot-Absorptionsspektrum von synthetischem Monohydrocalcit,CaCO3·H2O
Authors:Herta Effenberger
Institution:(1) Institut für Mineralogie und Kristallographie, Universität Wien, A-1010 Wien, Österreich
Abstract:The crystal structure of synthetic monohydrocalcite was solved withPatterson andFourier syntheses and refined for the subcell withá=6.0931 (9) Å,cacute=7.5446 (18) Å, space group P3121 or P3221,Z=3 toR w=0.039. Very weak superstructure reflections define a cell with 
$$a = a' \cdot  \sqrt 3 $$
andc=cacute, space group P31 or P32,Z=9. The superstructure result from ordering of the CO3 groups and was refined with rigid carbonate groups toR w=0.086. The interpretation of the IR spectrum is in agreement with the results of the X-ray structure analysis.
Keywords:Carbonate  CaCO3·  H2O  crystal structure  IR spectrum
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