Ab initio calculations on the ground and excited electronic states of AsI molecule including spin-orbit coupling

Publication date: Available online 28 December 2020Source: Computational and Theoretical ChemistryAuthor(s): Huagang Xiao, Shikui Dong, Jun Zhu, Tao Gao

Source: Computational and Theoretical Chemistry - December 29, 2020 Category: Chemistry Source Type: research