Computing the solid-liquid interfacial free energy and anisotropy of the Al-Mg system using a MEAM potential with atomistic simulations
Daniel Dolce, Amrutdyuti Swamy, J.J. Hoyt, Pabitra Choudhury
Topics & Concepts
Molecular dynamicsEmbedded atom modelAnisotropyThermodynamicsMaterials scienceAtom (system on chip)Surface energyAlloyLennard-Jones potentialMonte Carlo methodChemistryComputational chemistryPhysicsEmbedded systemQuantum mechanicsMathematicsStatisticsComputer scienceComposite materialAluminum Alloy Microstructure PropertiesBlock Copolymer Self-AssemblySolidification and crystal growth phenomena