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GUGA-based MRCI Approach with Core-Valence Separation Approximation (CVS) for the Calculation of the Core-Excited States of Molecules

Qi Song, Baoyuan Liu, Junfeng Wu,Wenli Zou,Yubin Wang,Bingbing Suo,Yibo Lei

JOURNAL OF CHEMICAL PHYSICS（2024）

引用 1|浏览5
关键词
Molecular Simulations
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