📣 Help Shape the Future of UKRI's Gateway to Research (GtR)

We're improving UKRI's Gateway to Research and are seeking your input! If you would be interested in being interviewed about the improvements we're making and to have your say about how we can make GtR more user-friendly, impactful, and effective for the Research and Innovation community, please email gateway@ukri.org.

Numerical Equivalence of Diabatic and Adiabatic Representations in Diatomic Molecules (2024)

First Author: Brady R

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/10.1021/acs.jctc.3c01150

Publication URI: http://dx.doi.org/10.1021/acs.jctc.3c01150

Type: Journal Article/Review

Parent Publication: Journal of Chemical Theory and Computation

Issue: 5