most citedExcitation Energies from Thermally-Assisted-Occupation Density Functional Theory: Theory and Computational Implementation

12 citations · 12 across the 1 of their papers we have counts for

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physics.chem-ph2020★ 12 cited

Excitation Energies from Thermally-Assisted-Occupation Density Functional Theory: Theory and Computational Implementation

Shu-Hao Yeh, Aaditya Manjanath, Yuan-Chung Cheng +2

The time-dependent density functional theory (TDDFT) has been broadly used to investigate the excited-state properties of various molecular systems. However, the current TDDFT heav…