Prediction of homolytic bond dissociation enthalpies for organic molecules at near chemical accuracy with sub-second computational cost
Prediction of homolytic bond dissociation enthalpies for organic molecules at near chemical accuracy with sub-second computational cost.
St John, P.; Guan, Y.; Kim, Y.; Kim, S.; Paton, R. S. Nat. Commun. 2020, 11, 2328