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Efficient exploration of reaction pathways using reaction databases and active learning. (2025)

First Author: Kuryla D

Attributed to: DiRAC-3 Operations 2023-26 - UCL - Additional Grant funded by STFC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1063/5.0235715

PubMed Identifier: 40116310

Publication URI: http://europepmc.org/abstract/MED/40116310

Type: Journal Article/Review

Volume: 162

Parent Publication: The Journal of chemical physics

Issue: 11

ISSN: 0021-9606