Molecular dynamics simulation of diffusivity

2008年第2卷第3期

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《能源前沿（英文）》 >> 2008年第2卷第3期 doi: 10.1007/s11708-008-0039-9

Molecular dynamics simulation of diffusivity

Power Engineering Department, Chongqing University;

发布日期： 2008-09-05

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摘要

Equilibrium molecular dynamics simulation was performed on water to calculate its diffusivity by adopting different potential models. The results show that the potential models have great influence on the simulated results. In addit

关键词

diffusivity ; Equilibrium molecular ; influence ; potential