Accurate energy barriers for catalytic reaction pathways: an automatic training protocol for machine learning force fields (2023)

First Author: Schaaf L

Attributed to: Support for the UKCP consortium funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1038/s41524-023-01124-2

Publication URI: http://dx.doi.org/10.1038/s41524-023-01124-2

Type: Journal Article/Review

Parent Publication: npj Computational Materials

Issue: 1