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Raw data and plotting script accompanying Regularized Perturbation Theory for Ab initio Solids

Raw data for the different systems presented in the paper can be found in Raw_data.csv. Python scripts to reproduce the figures presented in the manuscript are compiled as the notebook plots_final.ipynb. The GTH-cc-pV5Z basis set used for Ne is also included in this repository, in Q-Chem basis format.

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Data for "Regularized Perturbation Theory for Ab initio Solids"

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