Supplementary files for High-Throughput Screening of Catalysts for Electroreduction of CO2 to Methanol via Active Learning

Supporting files for High-Throughput Screening of Catalysts for Electroreduction of CO2 to Methanol via Active Learning. Include the original data for figures, a CSV format database for all adsorption energies and binding energies used in this work, and all CONTCARs to reproduce this work. The code for high-throughput DFT calculations and machine learning model training is available along with the supplementary files.