aug-cc-pV5Z

GPTKB entity

Statements (19)
Predicate Object
gptkbp:instanceOf basis set
gptkbp:abbreviation augmented correlation-consistent polarized valence 5-zeta
gptkbp:augmentation diffuse functions
gptkbp:basisSetType Gaussian-type orbital
gptkbp:developedBy gptkb:Thom_H._Dunning_Jr.
gptkbp:family correlation-consistent basis sets
gptkbp:fullName augmented correlation-consistent polarized valence 5-zeta
https://www.w3.org/2000/01/rdf-schema#label aug-cc-pV5Z
gptkbp:relatedTo gptkb:aug-cc-pVDZ
gptkb:aug-cc-pVTZ
aug-cc-pVQZ
cc-pV5Z
gptkbp:usedFor gptkb:density_functional_theory
correlated wavefunction methods
high-accuracy quantum chemical calculations
gptkbp:usedIn quantum chemistry
gptkbp:zetaLevel 5
gptkbp:bfsParent gptkb:Dunning_basis_sets
gptkbp:bfsLayer 8