Defect Energy Calculations of Nickel, Copper and Aluminium (and Their Alloys): Molecular Dynamics Approach
Swati Chaturvedi, Akarsh Verma, Sushanta K. Sethi, Shigenobu Ogata
Topics & Concepts
Vacancy defectStacking-fault energyNickelMaterials scienceStacking faultStackingAtom (system on chip)CopperDensity functional theoryAluminiumCrystallographyCrystallographic defectEmbedded atom modelPartial dislocationsMolecular dynamicsDislocationComputational chemistryMetallurgyChemistryComposite materialOrganic chemistryComputer scienceEmbedded systemMicrostructure and mechanical propertiesAluminum Alloy Microstructure PropertiesAluminum Alloys Composites Properties