PBE, PBE0, B86bPBE data and relative DNN-MBDQ dispersion corrections for S66x8 and S22 data sets.

Description

PBE, PB0 and B86bPBE interaction energy data for the S66x8 and/or S22 data sets as well as their relative DNN-MBDQ dispersion corrections for the different range-separation parameters (β) discussed.

Resources

Name Format Description Link
0 http://data.europa.eu/88u/dataset/oai-zenodo-org-7243660
0 http://data.europa.eu/88u/dataset/oai-zenodo-org-7243660

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