Morse potential energy function 莫尔斯势能函数
analytical potential energy function 解析势能函数 ; 分析势能函数
analytic potential energy function 分析势能函数
universal potential energy function 普适性势能函数
empirical potential energy function 经验势函数
Molecular potential energy function 分子势能函数
many-body potential energy function 多体展开势能函数
structure and potential energy function 分子结构与势能函数
Non-equilibrium molecular dynamics(NEMD) method and Tersoff potential energy function were used to simulate the vacancy structural defects effects on the lattice thermal conductivities of silicon thin films.
采用非平衡分子动力学(NEMD)方法及Tersoff势能函数模拟了微尺度下空位结构缺陷对单晶硅薄膜热导率的影响。
参考来源 - 空位缺陷对单晶硅薄膜热导率影响的分子动力学模拟研究·2,447,543篇论文数据，部分数据来源于NoteExpress
The chapter two introduces the theories which we use, mainly involving the molecular dynamics, the molecular potential energy function and molecular structures.
第二章介绍我们所要用到的理论知识，主要是涉及分子动力学，分子势能函数和分子结构。
The objective function in the model of prediction of protein structure is a potential energy function, either physics-based potentials or statistic-based potentials.
蛋白质结构预测模型的目标函数通常采用基于物理理论的经验势函数或基于统计理论的平均势能函数。
The contribution of shell structure to the potential energy function can be obtained from an analysis of relative energies of nucleonic configurations in a potential of given shapes.
通过分析在一给定形状的势能中核子组态的相对能量，可以得到壳结构对势能函数的贡献。
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