4.1 Review

An interaction potential for materials and molecular dynamics simulations.

期刊

QUIMICA NOVA
卷 24, 期 6, 页码 838-845

出版社

SOC BRASILEIRA QUIMICA
DOI: 10.1590/S0100-40422001000600022

关键词

interaction potential; molecular-dynamics simulation; structural correlations

向作者/读者索取更多资源

The Vashishta-Rahman effective interaction potential, based on the Pauling's concept of ionic radii, has been successfully employed to investigate structural and dynamical properties of different classes of material. By celebrating Pauling's birth centenary, we review the building up of the Vashishta-Rahman potential and we present molecular-dynamics simulation results for structure and dynamics of superionic materials, chalcogenide glasses and metallic oxides.

作者

我是这篇论文的作者
点击您的名字以认领此论文并将其添加到您的个人资料中。

评论

主要评分

4.1
评分不足

次要评分

新颖性
-
重要性
-
科学严谨性
-
评价这篇论文

推荐

暂无数据
暂无数据