Scaling exchange and correlation in the on-top density functional of multiconfiguration pair-density functional theory: effect on electronic excitation energies and bond energies

Presti, D. - Kadlec, Jan - Truhlar, D. G. - Gagliardi, L.
Scaling exchange and correlation in the on-top density functional of multiconfiguration pair-density functional theory: effect on electronic excitation energies and bond energies.
Theoretical Chemistry Accounts. Roč. 139, č. 2 (2020), č. článku 30. ISSN 1432-881X. E-ISSN 1432-2234
Obor OECD: Physical chemistry
Impakt faktor: 1.702, rok: 2020
Způsob publikování: Omezený přístup
https://link.springer.com/article/10.1007/s00214-019-2539-6
http://hdl.handle.net/11104/0306408