理论研究地面状态的 - 稀有气体范德瓦尔斯复合体:结合规则建模和ab initio计算

Samah Saidi1,2, Mohamed Bejaoui2, Hamid Berriche3,2

  • 1Department of Physics, College of Science and Humanities in Al-Kharj, Prince Sattam bin Abdulaziz University, Al-Kharj 11942, Saudi Arabi.

ACS omega
|August 5, 2024
PubMed
概括

这项研究使用唐-托尼斯潜力和ab initio方法模拟与稀有气体的相互作用. 结果显示了良好的协议,提供了对范德瓦尔斯债券和物种间差异的见解.

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