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Multistate Density Functional Theory

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2 results in Keywords: Multistate Density Functional Theory

Physical Chemistry

Leveling the Mountain Range of Excited-State Benchmarking through Multistate Density Functional Theory

Hong Zhu, Ruoqi Zhao, Meiyi Liu, Jun Zhang, Jiali Gao

Version 1 posted 21 July 2023

125

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Theoretical and Computational Chemistry

Excimer Energies

Ruoqi Zhao, Christian Hettich, Jun Zhang, Meiyi Liu, Jiali Gao

Version 1 posted 16 March 2023

202

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