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Theoretical and Computational Chemistry

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Quasi-Diabatic Propagation Scheme

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1 results in Keywords: Quasi-Diabatic Propagation Scheme

Theoretical and Computational Chemistry

Ab initio Spin-Mapping Non-adiabatic Dynamics Simulations of Photochemistry

Braden Weight, Arkajit Mandal, Deping Hu, Pengfei Huo

Version 1 posted 06 May 2024

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