Large-scale ab initio simulations based on systematically improvable atomic basis

标题
Large-scale ab initio simulations based on systematically improvable atomic basis
作者
关键词
First-principles, Computer code package, Large scale, Atomic basis
出版物
COMPUTATIONAL MATERIALS SCIENCE
Volume 112, Issue -, Pages 503-517
出版商
Elsevier BV
发表日期
2015-07-13
DOI
10.1016/j.commatsci.2015.07.004

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