Fast estimation of standard enthalpy of formation with chemical accuracy by artificial neural network correction of low-level-of-theory ab initio calculations

Autor: Plehiers, Pieter P., Lengyel, Istvan, West, David H., Marin, Guy B., Stevens, Christian V., Van Geem, Kevin M.
Zdroj: In Chemical Engineering Journal 15 December 2021 426
Databáze: ScienceDirect