Improving Density Functional Prediction of Molecular Thermochemical Properties with a Machine-Learning-Corrected Generalized Gradient Approximation.

Details

Language :

English

ISSN :

10895639

Volume :

126

Issue :

6

Database :

Supplemental Index

Journal :

Journal of Physical Chemistry A

Publication Type :

Academic Journal

Accession number :

156428284

Full Text :

https://doi.org/10.1021/acs.jpca.1c10491