Interfacial structure of WC-Fe metal-matrix composite (WC/Fe3W3C and Fe/Fe3W3C) stability, electronic and mechanical properties from first-principles calculations
Wengao Zhang, Zulai Li, Wei He, xinhua xiang, Fei Zhang, Quan Shan
Topics & Concepts
Materials scienceCovalent bondDensity functional theoryIonic bondingMetallic bondingChemical bondDensity of statesElectronic structureFermi levelComposite numberAdhesionMetalBond strengthBond energyComposite materialComputational chemistryMetallurgyCondensed matter physicsMoleculeLayer (electronics)AdhesiveElectronIonChemistryQuantum mechanicsPhysicsOrganic chemistryAdvanced materials and compositesAluminum Alloys Composites PropertiesMetal and Thin Film Mechanics