Gradients for configuration interaction energies with spin-orbit coupling in a semiempirical framework

标题
Gradients for configuration interaction energies with spin-orbit coupling in a semiempirical framework
作者
关键词
-
出版物
JOURNAL OF COMPUTATIONAL CHEMISTRY
Volume 32, Issue 12, Pages 2690-2696
出版商
Wiley
发表日期
2011-06-07
DOI
10.1002/jcc.21850

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