613 Wallace Road
Ames, IA 50011-2063
United States
Iowa State University
amorphous materials, As doping, local structure, threshold switching, Molecular dynamics
machine learning potential, Density functional theory, C60, diamond and amorphous diamond, structure search
chalcogenide glass, Si doping, local structure, threshold switching, mid-gap states, molecular dynamics
Fe-Co-N interstitials, magnetocrystalline anisotropy, Fe16N2, adaptive genetic algorithm, Density functional theory, rare-earth-free magnets
Aluminum-rare-earth alloy, molecular dynamics simulations, atomic structure analysis, genetic algorithm crystal search, machine learning interatomic potentials
Hydride superconductors, elemental substitution, mechanism of supercoudoctivity, DFT calculations