MOLPRO Basis Query, basis=STO-2G
Molpro basis library sto2g (STO-2G)
Generated from sto2g.bas at Tue Nov 16 17:37:11 GMT 1999
Literature Citation
Elements References
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H - He: W.J. Hehre, R.F. Stewart and J.A. Pople, J. Chem. Phys. 2657 (1969).
Li - Ne:
Na - Ar: W.J. Hehre, R. Ditchfield, R.F. Stewart, J.A. Pople, J. Chem. Phys.
K - Kr: 52, 2769 (1970).
HYDROGEN (2S) -> [1S]
HELIUM (2S) -> [1S]
LITHIUM (4S,2P) -> [2S,1P]
BERYLLIUM (4S,2P) -> [2S,1P]
BORON (4S,2P) -> [2S,1P]
CARBON (4S,2P) -> [2S,1P]
NITROGEN (4S,2P) -> [2S,1P]
OXYGEN (4S,2P) -> [2S,1P]
FLUORINE (4S,2P) -> [2S,1P]
NEON (4S,2P) -> [2S,1P]
SODIUM (6S,4P) -> [3S,2P]
MAGNESIUM (6S,4P) -> [3S,2P]
ALUMINUM (6S,4P) -> [3S,2P]
SILICON (6S,4P) -> [3S,2P]
PHOSPHORUS (6S,4P) -> [3S,2P]
SULFUR (6S,4P) -> [3S,2P]
CHLORINE (6S,4P) -> [3S,2P]
ARGON (6S,4P) -> [3S,2P]
POTASSIUM (8S,6P) -> [4S,3P]
CALCIUM (8S,6P) -> [4S,3P]
STRONTIUM (10S,8P,2D) -> [5S,4P,1D]