Chemical Science
Detection of multi-reference character imbalances enables a transfer learning approach for chemical discovery with coupled cluster accuracy at DFT cost
Chem. Sci., 2022, Accepted ManuscriptDOI: 10.1039/D2SC00393G, Edge Article Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Chenru Duan, Daniel B. K. Chu, Aditya Nandy, Heather KulikAppr…