Open Access
Implications of the DFT + U method on polaron properties in energy materials
Author(s) -
Zi Wang,
Casey N. Brock,
Amina Matt,
Kirk H. Bevan
Publication year - 2017
Publication title -
physical review. b./physical review. b
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.78
H-Index - 465
eISSN - 2469-9969
pISSN - 2469-9950
DOI - 10.1103/physrevb.96.125150
Subject(s) - density functional theory , polaron , projection (relational algebra) , materials science , hubbard model , physics , condensed matter physics , quantum mechanics , algorithm , computer science , superconductivity , electron