First-principles study of mechanical and thermodynamic properties of intermetallic Pt3M (M = Al, Hf, Zr, Co, Y, Sc)
Zongbo Li, Kai Xiong, Yingjie Sun, Chengchen Jin, Shunmeng Zhang, Junjie He, Yong Mao
Topics & Concepts
IntermetallicDebye modelMaterials scienceDensity functional theoryAnisotropyDensity of statesCondensed matter physicsThermodynamicsElectronic structureElastic modulusChemistryAlloyComputational chemistryMetallurgyComposite materialPhysicsQuantum mechanicsBoron and Carbon Nanomaterials ResearchMXene and MAX Phase MaterialsIntermetallics and Advanced Alloy Properties