MOLPRO Basis Query, basis=TZVP-DFT-orb
Molpro basis library tzvp_dft_orb (TZVP (DFT Orbital))
Generated from data/tzvp_dft_orb.bas at Mon Jul 5 14:00:21 BST 1999
Literature Citation
N. Godbout,6D. R. Salahub, J. Andzelm, and E. Wimmer, Can. J. Chem. 70, 560
(1992)
HYDROGEN (5s,1p) -> [3s,1p]
CARBON (10s,6p,1d) -> [4s,3p,1d]
NITROGEN (10s,6p,1d) -> [4s,3p,1d]
OXYGEN (10s,6p,1d) -> [4s,3p,1d]
FLUORINE (10s,6p,1d) -> [4s,3p,1d]
ALUMINUM (13s,9p,1d) -> [5s,4p,1d]
SILICON (13s,9p,1d) -> [5s,4p,1d]
PHOSPHORUS (13s,9p,1d) -> [5s,4p,1d]
SULFUR (13s,9p,1d) -> [5s,4p,1d]
CHLORINE (13s,9p,1d) -> [5s,4p,1d]
ARGON (13s,9p,1d) -> [5s,4p,1d]