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An efficient implementation of the NEVPT2 and CASPT2 methods avoiding higher-order density matrices

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Institution:前沿交叉科学青岛研究院

Title of Paper:An efficient implementation of the NEVPT2 and CASPT2 methods avoiding higher-order density matrices

Journal:Journal of Chemical Physics

First Author:Kollmar, Christian

Document Code:3CFCDB9359624224BE00CB497C102AC0

Volume:155

Issue:23

Translation or Not:No

Date of Publication:2021-12

Release Time:2024-06-13

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