期刊
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
卷 10, 期 32, 页码 4685-4687出版社
ROYAL SOC CHEMISTRY
DOI: 10.1039/b810017a
关键词
-
Water structure, measured by the height of the first peak in oxygen-oxygen radial distributions, is converged with respect to plane-wave basis energy cutoffs for ab initio molecular dynamics simulations, confirming the reliability of plane-wave methods.
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。
推荐
暂无数据