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1. ML-PBE ML-PBE Public

   This repo contains original scripts and data for the article "Improving Density Functional Prediction of Molecular Thermochemical Properties with a Machine-Learning_Corrected Generalized Gradient A…

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2. ML-DFA ML-DFA Public

   Scripts and dataset for "A Semilocal Machine-Learning Correction to Density Functional Approximations".

   Python