New Gradient Correction Scheme for Electronically Nonadiabatic Dynamics Involving Multiple Spin States

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Shu, Yinan, Zhang, Linyao, Wu, Dihua, Chen, Xiye, Sun, Shaozeng, Truhlar, Donald G.. 2023-04-20. New Gradient Correction Scheme for Electronically Nonadiabatic Dynamics Involving Multiple Spin States. https://doi.org/10.1021/acs.jctc.2c01173

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