MOLPRO Basis Query, basis=pV6Z
Molpro basis library pv6z (pV6Z)
Generated from pv6z.bas at Mon Dec 4 05:10:11 GMT 2000
Literature Citation
Elements References
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H: T. H. Dunning, Jr., (to be published).
C: A.D. Pradhan, H. Partridge and C.W. Bauschlicher, Jr., J. Chem.
Phys. 101, 3857 (1994) with correction to the p set.
O: (s,p) set from H. Partridge, (d,f,g) from T.H. Dunning, Jr.,
(h,i) from D. Feller.
N: C.W. Bauschlicher, Jr. and H. Partridge, J. Chem. Phys. 100,
4329 (1994).
HYDROGEN (10s,5p,4d,3f,2g,1h) -> [6s,5p,4d,3f,2g,1h]
CARBON (16s,11p,5d,4f,3g,2h,1i) -> [7s,6p,5d,4f,3g,2h,1i]
NITROGEN (16s,11p,5d,4f,3g,2h,1i) -> [7s,6p,5d,4f,3g,2h,1i]
OXYGEN (16s,10p,5d,4f,3g,2h,1i) -> [7s,6p,5d,4f,3g,2h,1i]