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cond-mat.soft2005
A Molecular Dynamics Computer Simulation Study of Room-Temperature Ionic Liquids: II. Equilibrium and Nonequilibrium Solvation Dynamics
Y. Shim, M. Y. Choi, H. J. Kim
The molecular dynamics (MD) simulation study of solvation structure and free energetics in 1-ethyl-3-methylimidazolium chloride and 1-ethyl-3-methylimidazolium hexafluorophosphate…
cond-mat.soft2005
A molecular dynamics computer simulation study of room-temperature ionic liquids. I. Equilibrium solvation structure and free energetics
Y. Shim, M. Y. Choi, Hyung J. Kim
Solvation in 1-ethyl-3-methylmidazolium chloride and in 1-ethyl-3-methylimidazolium hexafluorophosphate near equilibrium is investigated via molecular dynamics computer simulations…