Target State Optimized Density Functional Theory for Electronic Excited and Diabatic States

Autor:	Jun Zhang, Zhen Tang, Xiaoyong Zhang, Hong Zhu, Ruoqi Zhao, Yangyi Lu, Jiali Gao
Rok vydání:	2023
Předmět:	Physical and Theoretical Chemistry Computer Science Applications
Zdroj:	Journal of Chemical Theory and Computation. 19:1777-1789
ISSN:	1549-9626 1549-9618
DOI:	10.1021/acs.jctc.2c01317
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::6d9ea6a3bfd7a87dcee312101ea9cef5 https://doi.org/10.1021/acs.jctc.2c01317 Zobrazit plný text záznamu