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Tool for polaritonic perturbation theory based electronic structure calculations with MP, UCC and ADC

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BauerMarco/polaritonic_adcc

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Polaritonic_adcc is a python-based framework, which can be seen as an extension to the adcc package, with the purpose of computing the polaritonic perturbation theoretical electronic structure of molecules and clusters using MP, ADC and UCC.

The corresponding paper can be found here: https://doi.org/10.1063/5.0142403

If you use this package for a scientific publication, please cite the above paper.

The documentation, including information on installation and usage, can be found under the following url: https://bauermarco.github.io/polaritonic_adcc/

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Tool for polaritonic perturbation theory based electronic structure calculations with MP, UCC and ADC

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