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Prediction of structural stabilities of transition-metal disilicide alloys by the density functional theory
Journal article   Peer reviewed

Prediction of structural stabilities of transition-metal disilicide alloys by the density functional theory

Guosheng Shao
Acta Materialia, Vol.53(13), pp.3729-3736
2005

Abstract

Ab initio electronic theory CALPHAD density functional theory thermodynamics phase transformation

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