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@sunqm sunqm commented Nov 25, 2024

This PR ports the TDDFT-ris method developed in https://github.com/John-zzh/TDDFT-ris

References:
[1] Minimal Auxiliary Basis Set Approach for the Electronic Excitation Spectra
of Organic Molecules
Zehao Zhou, Fabio Della Sala, and Shane M. Parker
J. Phys. Chem. Lett. 2023, 14, 1968-1976

[2] Converging Time-Dependent Density Functional Theory Calculations in Five
Iterations with Minimal Auxiliary Preconditioning
Zehao Zhou and Shane M. Parker
J. Chem. Theory Comput. 2024, 20, 6738-6746

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