Molecular-dynamics evaluation of fluid-phase equilibrium properties by a novel free-energy perturbation approach : Application to gas solubility and vapor pressure of liquid hexane.
Molecular-dynamics evaluation of fluid-phase equilibrium properties by a novel free-energy perturbation approach : Application to gas solubility and vapor pressure of liquid hexane.
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通过新颖的自由能微扰方法对流体相平衡特性进行分子动力学评估:应用于液体己烷的气体溶解度和蒸气压。
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发表时间:
2006
期刊:
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通讯作者:
M.Fukuda
中科院分区:
文献类型:
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作者:
S.Kuwajima;H.Kikuchi;M.Fukuda