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most citedQuantum-Electrodynamical Time-Dependent Density Functional Theory. I. A Gaussian Atomic Basis Implementation

77 citations · 122 across the 4 of their papers we have counts for

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physics.chem-ph2023

DeePKS Model for Halide Perovskites with the Accuracy of Hybrid Functional

Qi Ou, Ping Tuo, Wenfei Li +3

Accurate prediction for the electronic structure properties of halide perovskites plays a significant role in the design of highly efficient and stable solar cells. While density f…