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机译:
Univ Posts & Telecommun, Coll Math & Phys, Nanjing, Jiangsu, Peoples R China;
Univ Posts & Telecommun, Coll Optoelect Engn, Nanjing, Jiangsu, Peoples R China;
self-diffusion coefficient; ionic liquids; velocity autocorrelation function; mean-square displacement; Einstein relation; Green-Kubo formulas; Arrhenius equation;
机译:Calculation of self-diffusion coefficients of the BMIMTFSA/water system by molecular dynamics simulation
机译:Molecular dynamics simulation of the reciprocal fused LiF-KBr mixture: Local structure and self-diffusion coefficients
机译:A molecular dynamics study of liquid aliphatic alcohols: Simulation of density and self-diffusion coefficient using a modified OPLS force field
机译:Redesign Namd Molecular Dynamics非粘结力场在Sunway ManiveCore处理器上
机译:Membrane Permeability Prediction of Drug-like Molecules with Molecular Dynamics and Free Energy Calculations =基于分子动力学和自由能计算 的药物分子膜渗透性预测
机译:Effect of Ion pairing on the solution Dynamics Investigated by the simulations of the Optical Kerr Effect and the Dielectric Relaxation spectra
机译:moglicheiten und Grenzen der sImULaTION mit Hilfe des“sYsTEm - DYNamICs”ansatzen von Forrester als methode der Untersuchung complexer systeme am Beispiel eines typischen Transportsystems der Luft - und Raumfahrt