RT-TDDFT #136
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RT-TDDFT #136
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I've been working here to add some of the integrals needed for velocity gauge GTH pseudopotentials to PySCF. |
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The RT-TDDFT implementation contributed by Dr. Kota Hanasaki (@khanasaki) and Dr. Bryan Wong.
More work is needed, e.g., fixing lint errors and adding tests and examples.
Please contact the original authors for further improvement.