本文利用分子间相互作用势模型研究了固体C_(60)的各种可能的取向状态。
The possible orientations in solid C60 were studied by using the model of classical molecular interaction.
根据c(60)晶体升华焓的实验值求得了C(60)分子间相互作用势的解析表达式。
An analytic interaction potential between C_ (60) molecules is obtained by using the experimental sublimation enthalpy.
在分子动力学模拟中,采用内嵌原子势描述纳米铜线的原子间相互作用。
The interatomic interactions of molecular dynamics model are described by embedded atom potential given by Doyama et al.
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