United States
Pennsylvania State University - Department of Mechanical Engineering
molecular dynamics, ReaxFF, Leaching, dissolution, mineral, reaction mechanism, hydrometallurgy, hydrothermal
Molecular dynamics, Yield sooting index, Density function theory
Molecular dynamics, ReaxFF, deuterium plasma, tungsten oxidation, reflection, retention, sputtering.
Molecular Dynamics of W-Li-O-D material, Development of the ReaxFF parameter set, Retention and sputtering with deuterium in range 1-75 eV, Lithium implantation in tungsten in range 1-150 eV.
Mesoporous silica, ReaxFF molecular dynamics, OPLS-AA molecular dynamics, Carbon fiber, Graphene, Carbonization
Keywords: Mixed solvents, Force field modeling, TpPa-1 composite membrane, Organic solvent nanofiltration, Solvated dye in mixed solvents.
