Browsing byAuthorGrofe, A
Showing results 1 to 2 of 2
Issue Date | Title | Author(s) |
2019-12-01 | Multistate density functional theory applied with 3 unpaired electrons in 3 orbitals: The singdoublet and tripdoublet states of the ethylene cation | Yang, L; Grofe, A; Reimers, J; Gao, J |
2020-02-01 | Source code, input data, and sample output concerning the application of multistate density functional theory to the singdoublet and tripdoublet states of the ethylene cation | Yang, L; Grofe, A; Reimers, JR; Gao, J |