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Half Antiperovskites III: crystallographic and electronic structure effects in Co-Shandites.

Weihrich, Richard ; Anusca, Irina


Half antiperovskites were investigated within the series Sn2-xInxCo3S2 by X-ray diffraction, thermal analysis, and DFT band structure calculations. The shandite type structure was confirmed from powder and single crystal diffraction for the studied compounds. Co orders like Ni in the previously studied InNi3/2S. SnCo3/2S is metrically pseudo cubic and can easily be deduced from the antiperovskite ...


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