STO-2G STO-3G STO-6G 3-21G 3-21++G 3-21G* 4-31G 6-31G 6-31++G 6-31G* 6-31G** 6-31+G* 6-31++G** 6-31G(3df,3pd) 6-311G 6-311G* 6-311G** 6-311++G** 6-311++G(2d,2p) 6-311G(2df,2pd) 6-311++G(3df,3pd) MINI (Huzinaga) MINI (Scaled) MIDI (Huzinaga) SV (Dunning-Hay) SVP (Dunning-Hay) SVP + Diffuse (Dunning-Hay) DZ (Dunning) DZP (Dunning) DZP + Diffuse (Dunning) Chipman DZP + Diffuse cc-pVDZ cc-pVTZ cc-pVQZ cc-pV5Z cc-pV6Z aug-cc-pVDZ aug-cc-pVTZ aug-cc-pVQZ aug-cc-pV5Z NASA Ames ANO Roos Augmented Double Zeta ANO Roos Augmented Triple Zeta ANO GAMESS VTZ GAMESS PVTZ Partridge Uncontr. 1 Partridge Uncontr. 2 Partridge Uncontr. 3 Ahlrichs VDZ Ahlrichs pVDZ Binning/Curtiss SV Binning/Curtiss VTZ Binning/Curtiss SVP Binning/Curtiss VTZP McLean/Chandler VTZ SV + Rydberg (Dunning-Hay) SVP + Rydberg (Dunning-Hay) SVP + Diffuse + Rydberg DZ + Rydberg (Dunning) DZP + Rydberg (Dunning) DZ + Double Rydberg (Dunning-Hay) SV + Double Rydberg (Dunning-Hay) Hay-Wadt MB (n+1) ECP Hay-Wadt VDZ (n+1) ECP SBKJC VDZ ECP Pople-style Diffuse 3-21G* Polarization 6-31G* Polarization 6-31G** Polarization 6-311G* Polarization 6-311G** Polarization Pople (2d,2p) Polarization Pople (2df,2pd) Polarization Pople (3df,3pd) Polarization HONDO7 Polarization Huzinaga Polarization Dunning-Hay Diffuse DHMS Polarization Dunning-Hay Rydberg Dunning-Hay Double Rydberg Binning-Curtiss (1d) Polarization Binning-Curtiss (df) Polarization Ahlrichs Polarization Glendening Polarization
GAMESS(US) Gaussian HONDO MELDF SUPERMOLECULE MOLPRO MOLCAS NWCHEM ACESII TX93
© H. S. Rzepa, 1996.