Author: Yuri Cho

Automatic prediction of flooring state spin for transition steel complexes

Digital Discovery, 2024, Accepted ManuscriptDOI: 10.1039/D4DD00093E, Paper Open Access &nbsp This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Yuri Cho, Ruben Laplaza, Sergi Vela, Clemence CorminboeufExploiting crystallographic data repositories for large-scale quantum chemical computations requires the rapid and accurate extraction of the