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Statements (17)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
computational chemistry method
|
| gptkbp:approximate |
electronic correlation
|
| gptkbp:basisFor |
wave function theory
|
| gptkbp:contrastsWith |
gptkb:Hartree–Fock_method
|
| gptkbp:developedBy |
20th century
|
| gptkbp:excludes |
gptkb:density_functional_theory
|
| gptkbp:field |
quantum chemistry
|
| https://www.w3.org/2000/01/rdf-schema#label |
post-Hartree–Fock methods
|
| gptkbp:include |
gptkb:Møller–Plesset_perturbation_theory
configuration interaction coupled cluster theory multi-configurational self-consistent field |
| gptkbp:purpose |
improve upon Hartree–Fock method
|
| gptkbp:requires |
greater computational resources
|
| gptkbp:usedFor |
accurate molecular electronic structure calculations
|
| gptkbp:bfsParent |
gptkb:Hartree–Fock_method
|
| gptkbp:bfsLayer |
4
|