화학공학소재연구정보센터
검색결과 : 9건
No. Article
1 A Simple Nonequilibrium Molecular-Dynamics Method for Calculating the Thermal-Conductivity
Mullerplathe F
Journal of Chemical Physics, 106(14), 6082, 1997
2 Solvation of Poly(Vinyl Alcohol) in Water, Ethanol and an Equimolar Water-Ethanol Mixture - Structure and Dynamics Studied by Molecular-Dynamics Simulation
Mullerplathe F, Vangunsteren WF
Polymer, 38(9), 2259, 1997
3 Local-Structure and Dynamics in Solvent-Swollen Polymers
Mullerplathe F
Macromolecules, 29(13), 4782, 1996
4 A Molecular-Dynamics Simulation Study with a Combined Quantum-Mechanical and Molecular Mechanical Potential-Energy Function - Solvation Effects on the Conformational Equilibrium of Dimethoxyethane
Liu HY, Mullerplathe F, Vangunsteren WF
Journal of Chemical Physics, 102(4), 1722, 1995
5 Determination of Force-Field Parameters for Molecular Simulation by Molecular Simulation - An Application of the Weak-Coupling Method
Njo SL, Vangunsteren WF, Mullerplathe F
Journal of Chemical Physics, 102(15), 6199, 1995
6 Unexpected Diffusion Behavior of Gas Molecules in Crystalline Poly(4-Methyl-1-Pentene)
Mullerplathe F
Journal of Chemical Physics, 103(10), 4346, 1995
7 Computer-Simulation of a Polymer Electrolyte - Lithium Iodide in Amorphous Poly(Ethylene Oxide)
Mullerplathe F, Vangunsteren WF
Journal of Chemical Physics, 103(11), 4745, 1995
8 A Force-Field for Liquid Dimethyl-Sulfoxide and Physical-Properties of Liquid Dimethyl-Sulfoxide Calculated Using Molecular-Dynamics Simulation
Liu HY, Mullerplathe F, Vangunsteren WF
Journal of the American Chemical Society, 117(15), 4363, 1995
9 Can Simple Quantum-Chemical Continuum Models Explain the Gauche Effect in Poly(Ethylene Oxide)
Mullerplathe F, Vangunsteren WF
Macromolecules, 27(21), 6040, 1994