High pressure molecular dynamics simulation of Au-x%Ni alloys

作者: J. Davoodi , F. Katouzi

DOI: 10.1063/1.4866596

关键词: Thermal expansionBinding energyMelting pointHeat capacityIsothermal processMolecular dynamicsPhase diagramChemistryIsobaric processThermodynamics

摘要: … as cohesive energy, under high pressure conditions. The molecular dynamics (MD) simulation … from computer simulation. The present study deals with the thermal properties of Au-x%Ni …

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