Publikationsdatum:
2017-08-23
Beschreibung:
Author(s): Thilo Aschebrock, Rickard Armiento, and Stephan Kümmel The Becke-Johnson model potential [A. D. Becke and E. R. Johnson, J. Chem. Phys. 124 , 221101 (2006) ] and the potential of the AK13 functional [R. Armiento and S. Kümmel, Phys. Rev. Lett. 111 , 036402 (2013) ] have been shown to mimic features of the exact Kohn-Sham exchange potential, such as step str... [Phys. Rev. B 96, 075140] Published Mon Aug 21, 2017
Schlagwort(e):
Electronic structure and strongly correlated systems
Print ISSN:
1098-0121
Digitale ISSN:
1095-3795
Thema:
Physik