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Analytic First-Order Nonadiabatic Coupling Matrix Elements of Spin- Adapted Open-Shell Time-Dependent Density Functional Theory

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Journal:J. Chem. Theory Comput.

First Author:X. L. Wang

Correspondence Author:Z. Wang*,W. Liu*

All the Authors:X. W. Wang

Volume:22

Page Number:9014-9038

Translation or Not:No

Date of Publication:2026-08

Included Journals:SCI

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