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Browsing by Author "Ntoahae, PS"

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  • Ngoepe, PE; Ntoahae, PS; Mangwejane, SS; Sithole, Happy M; Parker, SC; Wright, KV; De Leeuw, NH (Acad Science South Africa, 2005-09)
    The authors present the results of atomistic simulations using derived interatomic potentials for the pyrite-structured metal chalcogenides FeS2, PtSb2 and PtAs2. Structural and elastic constants were calculated and compared ...