Statements (22)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
computational method
|
| gptkbp:address |
self-interaction error
|
| gptkbp:amendedBy |
GGA functional
|
| gptkbp:appliesTo |
strongly correlated electron systems
|
| gptkbp:category |
computational physics
quantum chemistry |
| gptkbp:fullName |
Generalized Gradient Approximation plus Hubbard U
|
| https://www.w3.org/2000/01/rdf-schema#label |
GGA+U
|
| gptkbp:implementedIn |
gptkb:WIEN2k
gptkb:Quantum_ESPRESSO gptkb:VASP |
| gptkbp:improves |
treatment of localized d and f electrons
|
| gptkbp:introduced |
Hubbard U correction
|
| gptkbp:proposedBy |
gptkb:Vladimir_Anisimov
|
| gptkbp:relatedTo |
gptkb:LDA+U
gptkb:DFT+U |
| gptkbp:usedFor |
transition metal oxides
rare earth compounds |
| gptkbp:usedIn |
gptkb:density_functional_theory
|
| gptkbp:yearProposed |
1991
|
| gptkbp:bfsParent |
gptkb:DFT+U
|
| gptkbp:bfsLayer |
7
|