# Basis sets obtained from EMSL Basis Set Exchange : https://bse.pnl.gov/bse/portal

# File                         Name on EMSL BSE                         Description

3-21++g                        '3-21++G'                                VDZD Valence Double Zeta + Diffuse Functions on All Atoms
3-21g                          '3-21G'                                  VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
3-21gsp                        '3-21GSP'                                VDZD Valence Double Zeta
3-21++g_star                   '3-21++G*'                               VDZD Valence Double Zeta + Diffuse Functions + Polarization
3-21g_star                     '3-21G*'                                 VDZP Valence Double Zeta + Polarization on Second Row Atoms
4-22gsp                        '4-22GSP'                                VDZD Valence Double Zeta
4-31g                          '4-31G'                                  VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
5zp                            '5ZP'                                    All-electron 5 zeta plus polarization functions.
6-311++g_2d_2p                 '6-311++G(2d,2p)'                        VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
6-311g_2df_2pd                 '6-311G(2df,2pd)'                        VTZ2P Valence Triple Zeta + Double Polarization
6-311++g_3df_3pd               '6-311++G(3df,3pd)'                      VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
6-311g                         '6-311G'                                 VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
6-311+g_star                   '6-311+G*'                               VTZPD Valence Triple Zeta + Polarization + Diffuse on Heavy Atoms
6-311G_star                    '6-311G*'                                VTZP Valence Triple Zeta + Polarization on Nonhydrogen
6-311++g_star_star             '6-311++G**'                             VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
6-311G_star_star               '6-311G**'                               VTZP Valence Triple Zeta + Polarization on All Atoms
6-31g_3df_3pd                  '6-31G(3df,3pd)'                         VDZ3P Valence Double Zeta + Triple Polarization on All Atoms
6-31++g                        '6-31++G'                                VDZD Valence Double Zeta + Diffuse Functions on All Atoms
6-31g                          '6-31G'                                  VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
6-31+g                         '6-31+G'                                 VDZ Valence Double Zeta: 2 Funct.'s/Valence AO + Diffuse Functions on Heavy Atoms
6-31g-Blaudeau                 '6-31G-Blaudeau'                         VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
6-31++g_star                   '6-31++G*'                               VDZD Valence Double Zeta + Diffuse Functions on All Atoms
6-31+g_star                    '6-31+G*'                                VDZPD Valence Double Zeta + Polarization (Li-Ar)
6-31g_star                     '6-31G*'                                 VDZP Valence Double Zeta + Polarization (Li-Ar)
6-31g_star-Blaudeau            '6-31G*-Blaudeau'                        VDZP Valence Double Zeta + Polarization on All Atoms
6-31++g_star_star              '6-31++G**'                              VDZPD Valence Double Zeta + Diffuse and Polarization Functions
6-31g_star_star                '6-31G**'                                VDZP Valence Double Zeta + Polarization on All Atoms
6zp                            '6ZP'                                    All-electron 6 zeta plus polarization functions
ano2_ames                      'NASA Ames ANO2'                         VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
ano_ames                       'NASA Ames ANO'                          VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
ano_bauschlicher               'Bauschlicher ANO'                       VQZ3P Valence Quadruple zeta + Polarization on All Atoms
ano-pvdz_ecp_bfd               'N/A'                                    ANO Double Zeta basis set to be used with BFD pseudo-potentials
ano-pvqz_ecp_bfd               'N/A'                                    ANO Quadruple Zeta basis set to be used with BFD pseudo-potentials
ano-pvtz_ecp_bfd               'N/A'                                    ANO Triple Zeta basis set to be used with BFD pseudo-potentials
ano-rcc                        'ANO-RCC'                                full ANO-RCC basis, reduce to get MB, VDZP, VTZP and VQZP quality
apr-cc-pv_q+d_z                'apr-cc-pV(Q+d)Z'                        apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
aug-5zp                        'A5ZP'                                   All-electron augmented 5ZP.
aug-ano-pvdz_roos              'Roos Augmented Double Zeta ANO'         VDZPD Valence Double Zeta + Polarization + Diffuse
aug-ano-pvtz_roos              'Roos Augmented Triple Zeta ANO'         VTZ2PD Valence Triple Zeta + Polarization + Diffuse
aug-cc-pcv5z                   'aug-cc-pCV5Z'                           5Z4PD Quintuple Zeta + Polarization + Diffuse
aug-cc-pcvdz                   'aug-cc-pCVDZ'                           DZ2PD Double Zeta + Polarization + Diffuse on All Atoms
aug-cc-pcvqz                   'aug-cc-pCVQZ'                           QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
aug-cc-pcv_t+d_z               'aug-cc-pCV(T+d)Z'                       Core-valence basis sets for second-row atoms (Al-Ar)
aug-cc-pcvtz                   'aug-cc-pCVTZ'                           TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
aug-cc-pv_5+d_z                'aug-cc-pV(5+d)Z'                        V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
aug-cc-pv5z                    'aug-cc-pV5Z'                            V5Z4PD Valence Quintuple Zeta + Polarization + Diffuse
aug-cc-pv5z_ecp_bfd            'N/A'                                    Augmented Quintuple Zeta basis set to be used with BFD pseudo-potentials
aug-cc-pv5z-pp                 'aug-cc-pV5Z-PP'                         V5ZPD Valence Quintuple Zeta + Polarization on All Atoms
aug-cc-pv_6+d_z                'aug-cc-pV(6+d)Z'                        V6Z5P Valence Sextuple Zeta + Polarization + Diffuse
aug-cc-pv6z                    'aug-cc-pV6Z'                            V6Z5P Valence Sextuple Zeta + Polarization + Diffuse
aug-cc-pv_d+d_z                'aug-cc-pV(D+d)Z'                        VDZ2PD Valence Double Zeta + Polarization + Diffuse
aug-cc-pvdz                    'aug-cc-pVDZ'                            VDZ2PD Valence Double Zeta + Polarization + Diffuse
aug-cc-pvdz_ecp_bfd            'N/A'                                    Augmented Double Zeta basis set to be used with BFD pseudo-potentials
aug-cc-pvdz-pp                 'aug-cc-pVDZ-PP'                         VDZPD Valence Double Zeta + Polarization on All Atoms
aug-cc-pv_q+d_z                'aug-cc-pV(Q+d)Z'                        VQZ3PD Valence Quadruple Zeta + Polarization + Diffuse
aug-cc-pvqz                    'aug-cc-pVQZ'                            VQZ3PD Valence Quadruple Zeta + Polarization + Diffuse
aug-cc-pvqz_ecp_bfd            'N/A'                                    Augmented Quadruple Zeta basis set to be used with BFD pseudo-potentials
aug-cc-pvqz-nr                 'aug-cc-pVQZ-NR'                         VQZPD All-electron non-relativistic Valence Quadruple Zeta + Polarization
aug-cc-pvqz-pp                 'aug-cc-pVQZ-PP'                         VQZPD Valence Quadruple Zeta + Polarization on All Atoms
aug-cc-pvqz_sbd                'SDB-aug-cc-pVQZ'                        VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
aug-cc-pv_t+d_z                'aug-cc-pV(T+d)Z'                        VTZ2PD Valence Triple Zeta + Polarization + Diffuse
aug-cc-pvtz                    'aug-cc-pVTZ'                            VTZ2PD Valence Triple Zeta + Polarization + Diffuse
aug-cc-pvtz_ecp_bfd            'N/A'                                    Augmented Triple Zeta basis set to be used with BFD pseudo-potentials
aug-cc-pvtz-nr                 'aug-cc-pVTZ-NR'                         VTZ2P All-electron non-relativistic Valence Triple Zeta + Polarization
aug-cc-pvtz-pp                 'aug-cc-pVTZ-PP'                         VTZPD Valence Triple Zeta + Polarization on All Atoms
aug-cc-pvtz_sbd                'SDB-aug-cc-pVTZ'                        VTZ2P Valence Triple Zeta + Polarization on All Atoms
aug-cc-pwcv5z                  'aug-cc-pwCV5Z'                          5Z4P Quintuple Zeta + Polarization on All Atoms
aug-cc-pwcv5z-nr               'aug-cc-pwCV5Z-NR'                       V5ZPD All-electron non-relativistic Core-Valence Quintuple Zeta + Polarization
aug-cc-pwcvdz                  'aug-cc-pwCVDZ'                          DZP Double Zeta + Polarization + Tight Core
aug-cc-pwcvqz                  'aug-cc-pwCVQZ'                          QZ3PD Quadruple Zeta + Polarization +Diffuse on All Atoms
aug-cc-pwcvqz-nr               'aug-cc-pwCVQZ-NR'                       VQZPD All-electron non-relativistic Core-Valence Quadruple Zeta + Polarization
aug-cc-pwcvtz                  'aug-cc-pwCVTZ'                          TZ2PD Triple Zeta + Polarization + Diffuse on All Atoms
aug-cc-pwcvtz-nr               'aug-cc-pwCVTZ-NR'                       VTZ2P All-electron non-relativistic Core-Valence Triple Zeta + Polarization
aug-dzp                        'ADZP'                                   All-electron augmented DZP.
aug-pc-0                       'aug-pc-0'                               N/A
aug-pc-1                       'aug-pc-1'                               N/A
aug-pc-2                       'aug-pc-2'                               N/A
aug-pc-3                       'aug-pc-3'                               N/A
aug-pc-4                       'aug-pc-4'                               N/A
aug-pcj-0_2006                 'aug-pcJ-0_2006'                         N/A
aug-pcj-0                      'aug-pcJ-0'                              N/A
aug-pcj-1_2006                 'aug-pcJ-1_2006'                         N/A
aug-pcj-1                      'aug-pcJ-1'                              N/A
aug-pcj-2_2006                 'aug-pcJ-2_2006'                         N/A
aug-pcj-2                      'aug-pcJ-2'                              N/A
aug-pcj-3_2006                 'aug-pcJ-3_2006'                         N/A
aug-pcj-3                      'aug-pcJ-3'                              N/A
aug-pcj-4_2006                 'aug-pcJ-4_2006'                         N/A
aug-pcj-4                      'aug-pcJ-4'                              N/A
aug-pcS-0                      'aug-pcS-0'                              N/A
aug-pcS-1                      'aug-pcS-1'                              N/A
aug-pcs-2                      'aug-pcS-2'                              N/A
aug-pcs-3                      'aug-pcS-3'                              N/A
aug-pcs-4                      'aug-pcS-4'                              N/A
aug-pcseg-0                    'aug-pcseg-0'                            Valence Double Zeta, Diffuse Augmented, DFT Optimized
aug-pcseg-1                    'aug-pcseg-1'                            Polarized Valence Double Zeta, Diffuse Augmented, DFT Optimized
aug-pcseg-2                    'aug-pcseg-2'                            Polarized Valence Triple Zeta, Diffuse Augmented, DFT Optimized
aug-pcseg-3                    'aug-pcseg-3'                            Polarized Valence Quadruple Zeta, Diffuse Augmented, DFT Optimized
aug-pcseg-4                    'aug-pcseg-4'                            Polarized Valence Pentuble Zeta, Diffuse Augmented, DFT Optimized
aug-pcsseg-0                   'aug-pcSseg-0'                           N/A
aug-pcsseg-1                   'aug-pcSseg-1'                           N/A
aug-pcsseg-2                   'aug-pcSseg-2'                           N/A
aug-pcsseg-3                   'aug-pcSseg-3'                           N/A
aug-pcsseg-4                   'aug-pcSseg-4'                           N/A
aug-pv7z                       'aug-pV7Z'                               V7Z6P Valence Septuple Zeta + Polarization on All Atoms
aug-qzp                        'AQZP'                                   All-electron augmented QZP.
aug-tzp                        'ATZP'                                   All-electron augmented TZP.
cc-pcv5z0                      'cc-pCV5Z0'                              V5Z4P Valence Quintuple Zeta + Tight s and p functions
cc-pcv5z_ames                  'NASA Ames cc-pCV5Z'                     V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
cc-pcv5z                       'cc-pCV5Z'                               N/A
cc-pcv6z                       'cc-pCV6Z'                               correlation consistent core-valence sextuple-zeta basis sets for Al-Ar
cc-pcvdz                       'cc-pCVDZ'                               DZP Double Zeta + Polarization + Tight Core
cc-pcvqz_ames                  'NASA Ames cc-pCVQZ'                     VTZ2P Valence Triple Zeta + Polarization on All Atoms
cc-pcvqz                       'cc-pCVQZ'                               QZ3P Quadruple Zeta + Polarization + Tight Core
cc-pcvtz_ames                  'NASA Ames cc-pCVTZ'                     VTZ2P Valence Triple Zeta + Polarization on All Atoms
cc-pcvtz                       'cc-pCVTZ'                               TZ2P Triple Zeta + Polarization + Tight Core
cc-pv_5+d_z                    'cc-pV(5+d)Z'                            V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
cc-pv5z_ames                   'NASA Ames cc-pV5Z'                      V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
cc-pv5z                        'cc-pV5Z'                                V5Z4P Valence Quintuple Zeta + Polarization on All Atoms
cc-pv5z_ecp_bfd                'N/A'                                    Quintuple Zeta basis set to be used with BFD pseudo-potentials
cc-pv5z-nr                     'cc-pV5Z-NR'                             5Z4P All-electron non-relativistic Valence Quintuple Zeta + Polarization
cc-pv5z-pp                     'cc-pV5Z-PP'                             cc-pV5Z-PP for Hf - Pt
cc-pv_6+d_z                    'cc-pV(6+d)Z'                            V6Z5P Valence Sextuple Zeta + Polarization on All Atoms
cc-pv6z                        'cc-pV6Z'                                V6Z5P Valence Sextuple Zeta + Polarization on All Atoms
cc-pv8z                        'cc-pV8Z'                                V7Z6P Valence Octuple Zeta + Polarization on All Atoms
cc-pv9z                        'cc-pV9Z'                                V7Z6P Valence Octuple Zeta + Polarization on All Atoms
cc-pv_d+d_z                    'cc-pV(D+d)Z'                            VDZP Valence Double Zeta + Polarization on All Atoms
cc-pvdz                        'cc-pVDZ'                                VDZP Valence Double Zeta + Polarization on All Atoms
cc-pvdz_ecp_bfd                'N/A'                                    Double Zeta basis set to be used with BFD pseudo-potentials
cc-pvdz-pp                     'cc-pVDZ-PP'                             cc-pVDZ-PP for Hf - Pt
cc-pv_q+d_z                    'cc-pV(Q+d)Z'                            VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
cc-pvqz_ames                   'NASA Ames cc-pVQZ'                      VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
cc-pvqz                        'cc-pVQZ'                                VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
cc-pvqz_ecp_bfd                'N/A'                                    Quadruple Zeta basis set to be used with BFD pseudo-potentials
cc-pvqz-nr                     'cc-pVQZ-NR'                             QZ3P All-electron non-relativistic Valence Quadruple Zeta + Polarization
cc-pvqz-pp                     'cc-pVQZ-PP'                             N/A
cc-pvqz_sdb                    'SDB-cc-pVQZ'                            VQZ3P Valence Quadruple Zeta + Polarization on All Atoms
cc-pv_t+d_z+                   'cc-pV(T+d)Z+'                           cc-pV(T+d)Z+ basis set is the cc-pV(T+d)Z+ basis set of Dunning and coworkers augmented with only s and p diffuse functions of Pople and coworkers on the heavy atoms.
cc-pv_t+d_z                    'cc-pV(T+d)Z'                            VTZ2P Valence Triple Zeta + Polarization on All Atoms
cc-pvtz_ames                   'NASA Ames cc-pVTZ'                      VTZ2P Valence Triple Zeta + Polarization on All Atoms
cc-pvtz+                       'cc-pVTZ+'                               cc-pVTZ basis set augmented with diffuse functions from 6-31+G basis set.
cc-pvtz                        'cc-pVTZ'                                VTZ2P Valence Triple Zeta + Polarization on All Atoms
cc-pvtz_ecp_bfd                'N/A'                                    Triple Zeta basis set to be used with BFD pseudo-potentials
cc-pvtz-nr                     'cc-pVTZ-NR'                             TZ2P All-electron non-relativistic Valence Triple Zeta + Polarization
cc-pvtz-pp                     'cc-pVTZ-PP'                             cc-pVTZ-PP for Hf - Pt
cc-pvtz_sdb                    'SDB-cc-pVTZ'                            VTZ2P Valence Triple Zeta + Polarization on All Atoms
cc-pwcv5z                      'cc-pwCV5Z'                              5Z4P Quintuple Zeta + Polarization + Tight Core
cc-pwcv5z-nr                   'cc-pwCV5Z-NR'                           5Z4P All-electron non-relativistic Core-Valence Quintuple Zeta + Polarization
cc-pwcv5z-pp                   'cc-pwCV5Z-PP'                           cc-pwCV5Z-PP for Hf - Pt
cc-pwcvdz                      'cc-pwCVDZ'                              DZP Double Zeta + Polarization + Tight Core
cc-pwcvdz-pp                   'cc-pwCVDZ-PP'                           N/A
cc-pwcvqz                      'cc-pwCVQZ'                              QZ3P Quadruple Zeta + Polarization + Tight Core
cc-pwcvqz-nr                   'cc-pwCVQZ-NR'                           QZ3P All-electron non-relativistic Core-Valence Quadruple Zeta + Polarization
cc-pwcvqz-pp                   'cc-pwCVQZ-PP'                           N/A
cc-pwcvtz                      'cc-pwCVTZ'                              TZ2P Triple Zeta + Polarization + Tight Core
cc-pwcvtz-nr                   'cc-pwCVTZ-NR'                           TZ2P All-electron non-relativistic Core-Valence Triple Zeta + Polarization
chipman-dzp                    'Chipman DZP'                            DZP Double Zeta + Polarization
chipman-dzp+diffuse            'Chipman DZP + Diffuse'                  DZPD Double Zeta + Polarization + Diffuse
d-aug-cc-pv5z                  'd-aug-cc-pV5Z'                          V5Z4PD Valence Quintuple Zeta + Polarization + Diffuse
d-aug-cc-pv6z                  'd-aug-cc-pV6Z'                          V6Z5P Valence Sextuple Zeta + Polarization + Diffuse
d-aug-cc-pvdz                  'd-aug-cc-pVDZ'                          VDZ2PD Valence Double Zeta + Polarization + Diffuse
d-aug-cc-pvqz                  'd-aug-cc-pVQZ'                          VQZ3PD Valence Quadruple Zeta + Polarization + Diffuse
d-aug-cc-pvtz                  'd-aug-cc-pVTZ'                          VTZ2PD Valence Triple Zeta + Polarization + Diffuse
def2-qzvpd                     'Def2-QZVPD'                             def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
def2-qzvp                      'Def2-QZVP'                              N/A
def2-qzvppd                    'Def2-QZVPPD'                            def2-QZVPPD Quadruple-Zeta-Valence basis set + Two Sets of Polarization + Diffuse basis functions
def2-qzvpp                     'Def2-QZVPP'                             N/A
def2-svpd                      'Def2-SVPD'                              def2-SVPD Split-Valence basis set + Polarization + Diffuse basis functions
def2-sv_p                      'Def2-SV(P)'                             N/A
def2-svp                       'Def2-SVP'                               N/A
def2-tzvpd                     'Def2-TZVPD'                             def2-TZVPD Triple-Zeta-Valence basis set + Polarization + Diffuse basis functions
def2-tzvp                      'Def2-TZVP'                              N/A
def2-tzvppd                    'Def2-TZVPPD'                            def2-TZVPPD Triple-Zeta-Valence basis set + Two Sets of Polarization + Diffuse basis functions
def2-tzvpp                     'Def2-TZVPP'                             N/A
dunning_tz                     'TZ (Dunning)'                           VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
dz_dunning                     'DZ (Dunning)'                           DZ Double Zeta: 2 Functions/AO
dz_dunning-hay                 'DZ + Double Rydberg (Dunning-Hay)'      DZ2R Double Zeta + Double Rydberg Functions
dzpd_dunning                   'DZP + Diffuse (Dunning)'                DZPD Double Zeta + Polarization + Diffuse
dzp_dunning                    'DZP (Dunning)'                          DZP Double Zeta + Polarization on All Atoms
dzp                            'DZP'                                    All-electron double zeta plus polarization functions.
dzpr_dunning                   'DZP + Rydberg (Dunning)'                DZP1R Double Zeta + Polarization on All Atoms
dzq                            'DZQ'                                    N/A
dzr_dunning                    'DZ + Rydberg (Dunning)'                 DZ1R Double Zeta: 2 Functions/AO
dzvp2                          'DZVP2 (DFT Orbital)'                    VDZP Valence Double Zeta + Polarization designed for DFT
dzvp                           'DZVP (DFT Orbital)'                     VDZP Valence Double Zeta + Polarization designed for DFT
ecp10mdf                       'ECP10MDF'                               N/A
ecp60mdf                       'ECP60MDF'                               N/A
iglo-ii                        'IGLO-II'                                VDZP Valence Double Zeta + Polarization on All Atoms
iglo-iii                       'IGLO-III'                               VTZP Valence Triple Zeta + Polarization on All Atoms
jul-cc-pv_d+d_z                'jul-cc-pV(D+d)Z'                        jul-cc-pV(D+d)Z basis set is a partially augmented cc-pV(D+d)Z basis set of Dunning and coworkers
jul-cc-pv_q+d_z                'jul-cc-pV(Q+d)Z'                        jul-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
jul-cc-pv_t+d_z                'jul-cc-pV(T+d)Z'                        jul-cc-pV(T+d)Z basis set is a partially augmented cc-pV(T+d)Z basis set of Dunning and coworkers
jun-cc-pv_d+d_z                'jun-cc-pV(D+d)Z'                        jun-cc-pV(D+d)Z basis set is a partially augmented cc-pV(D+d)Z basis set of Dunning and coworkers
jun-cc-pv_q+d_z                'jun-cc-pV(Q+d)Z'                        jun-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
jun-cc-pv_t+d_z                'jun-cc-pV(T+d)Z'                        jun-cc-pV(T+d)Z basis set is a partially augmented cc-pV(T+d)Z basis set of Dunning and coworkers
lanl08d                        'LANL08d'                                Uncontracted basis + Polarization + Diffuse ECP
lanl08f                        'LANL08(f)'                              uncontracted basis set + f polarization
lanl08                         'LANL08'                                 Uncontracted basis set
lanl08+                        'LANL08+'                                uncontracted basis set + diffuse d function
lanl2dzdp_ecp                  'LANL2DZdp ECP'                          DZP Double Zeta + Polarization + Diffuse ECP
lanl2dz_ecp                    'LANL2DZ ECP'                            DZ Double Zeta Basis Set designed for an ECP
lanl2dz_mod                    'modified LANL2DZ'                       transition-metal LANL2DZ basis sets including optimized outer p functions
lanl2tzf                       'LANL2TZ(f)'                             TZ triple zeta basis set designed for an ECP + f polarization
lanl2tz                        'LANL2TZ'                                N/A
lanl2tz+                       'LANL2TZ+'                               TZ triple zeta basis set designed for an ECP + diffuse d function
m6-31g                         'm6-31G'                                 Improved 6-31G basis set for first-row transition metals
maug-cc-pv_d+d_z               'maug-cc-pV(D+d)Z'                       maug-cc-pV(D+d)Z basis set is the cc-pV(D+d)Z basis set of Dunning and coworkers augmented with only s and p diffuse functions on the heavy atoms. This basis set is called minimally augmented cc-pV(D+d)Z, which we abbreviate maug-cc-pV(D+d)Z.
maug-cc-pvdz                   'maug-cc-pVDZ'                           maug-cc-pVDZ basis set is the cc-pVDZ basis set of Dunning and coworkers augmented with only s and p diffuse functions on the heavy atoms. This basis set is called minimally augmented cc-pVDZ, which we abbreviate maug-cc-pVDZ.
maug-cc-pv_q+d_z               'maug-cc-pV(Q+d)Z'                       maug-cc-pV(Q+d)Z basis set is the cc-pV(Q+d)Z basis set of Dunning and coworkers augmented with only s and p diffuse functions on the heavy atoms. This basis set is called minimally augmented cc-pV(Q+d)Z, which we abbreviate maug-cc-pV(Q+d)Z.
maug-cc-pvqz                   'maug-cc-pVQZ'                           maug-cc-pVQZ basis set is the cc-pVQZ basis set of Dunning and coworkers augmented with only s and p diffuse functions on the heavy atoms. This basis set is called minimally augmented cc-pVQZ, which we abbreviate maug-cc-pVQZ
maug-cc-pv_t+d_z               'maug-cc-pV(T+d)Z'                       Minimally augmented cc-pV(T+d)Z
maug-cc-pvtz                   'maug-cc-pVTZ'                           maug-cc-pVTZ basis set is the cc-pVTZ basis set of Dunning and coworkers augmented with only s and p diffuse functions on the heavy atoms. This basis set is called minimally augmented cc-pVTZ, which we abbreviate maug-cc-pVTZ.
may-cc-pv_q+d_z                'may-cc-pV(Q+d)Z'                        may-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers
may-cc-pv_t+d_z                'may-cc-pV(T+d)Z'                        may-cc-pV(T+d)Z basis set is a partially augmented cc-pV(T+d)Z basis set of Dunning and coworkers
mb_ecp_hay-wadt                'Hay-Wadt MB (n+1) ECP'                  MB Minimal Basis Set designed for an ECP
mg3s                           'MG3S'                                   MG3S is a triple-zeta polarized basis set with diffuse functions on all heavy atoms. It is a modification of Pople's 6-311++G** basis set.
midi_bang                      'MIDI!'                                  VDZP Valence Double Zeta + Polarization on some atoms
midi_huzinaga                  'MIDI (Huzinaga)'                        VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
mini_huzinaga                  'MINI (Huzinaga)'                        MB Minimal Basis: 1 Function/AO
mini                           'MINI (Scaled)'                          MB Minimal Basis: 1 Function/AO
pv6z                           'pV6Z'                                   V6Z5P Valence Sextuple Zeta + Polarization on All Atoms
pv7z                           'pV7Z'                                   V7Z6P Valence Septuple Zeta + Polarization on All Atoms
pvdz_ahlrichs                  'Ahlrichs pVDZ'                          VDZP Valence Double Zeta + Polarization on All Atoms
pvtz_gamess                    'GAMESS PVTZ'                            VTZP Valence Triple Zeta + Polarization on All Atoms
pvtz_sadlej                    'Sadlej pVTZ'                            VTZ2P Valence Triple zeta + Polarization on All Atoms
qzp                            'QZP'                                    All-electron quadruple zeta plus polarization functions.
rlc_ecp_stuttgart              'Stuttgart RLC ECP'                      DZ Double Zeta Basis Set designed for an ECP
rsc_ano_ecp_stuttgart          'Stuttgart RSC ANO/ECP'                  QZ Quadruple Zeta Basis Set designed for an ECP
rsc_ecp_stuttgart              'Stuttgart RSC 1997 ECP'                 DZ Double Zeta Basis Set designed for an ECP
sbkjc_p_2d                     'SBKJC Polarized (p,2d) - LFK'           N/A
sto-2g                         'STO-2G'                                 MB Minimal Basis: 1 Function/AO
sto-3g_star                    'STO-3G*'                                MBP Minimal Basis + Polarization on second row
sto-3g                         'STO-3G'                                 MB Minimal Basis: 1 Function/AO
sto-6g_star                    'STO-6G'                                 MB Minimal Basis: 1 Function/AO
sv_binning-curtiss             'Binning/Curtiss SV'                     VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
sv_dunning-hay                 'SV (Dunning-Hay)'                       VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
svp_binning-curtiss            'Binning/Curtiss SVP'                    VDZP Valence Double Zeta + Polarization
svpd_dunning-hay               'SVP + Diffuse (Dunning-Hay)'            VDZPD Valence Double Zeta + Polarization + Diffuse
svpdr                          'SVP + Diffuse + Rydberg'                VDZPD1R Valence Double Zeta + Polar. + Diffuse + Rydberg
svp_dunning-hay                'SVP (Dunning-Hay)'                      VDZP Valence Double Zeta + Polarization on All Atoms
svpr_dunning-hay               'SVP + Rydberg (Dunning-Hay)'            VDZP1R Valence Double Zeta + Polarization + Rydberg
svr_dunning-hay                'SV + Rydberg (Dunning-Hay)'             VDZ1R Valence Double Zeta + Diffuse Rydberg Functions
svrr_dunning-hay               'SV + Double Rydberg (Dunning-Hay)'      Valence Double Zeta + Double Rydberg Functions
tzp                            'TZP'                                    All-electron triple zeta plus polarization functions.
tzv_ahlrichs                   'Ahlrichs TZV'                           VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
tzvp                           'TZVP (DFT Orbital)'                     VTZP Valence Triple Zeta + Polarization designed for DFT
ugbs                           'UGBS'                                   UGBS basis by de Castro and Jorge
uncontracted_1_partridge       'Partridge Uncontracted 1'               1D UNCONTR Uncontracted (s,p) Sets (Smallest)
uncontracted_2_partridge       'Partridge Uncontracted 2'               1D UNCONTR Uncontracted (s,p) Sets (Intermediate)
uncontracted_3_partridge       'Partridge Uncontracted 3'               1D UNCONTR Uncontracted (s,p) Sets (Large)
uncontracted_4_partridge       'Partridge Uncontracted 4'               1D UNCONTR Uncontracted (s,p) Sets (Large)
vdz_ahlrichs                   'Ahlrichs VDZ'                           VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
vdz_ecp_hay-wadt               'Hay-Wadt VDZ (n+1) ECP'                 VDZ Valence Double Zeta designed for an ECP
vdz_sbkjc_ecp                  'SBKJC VDZ ECP'                          VDZ Valence Double Zeta designed for an ECP
vtz_ahlrichs                   'Ahlrichs VTZ'                           VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
vtz_binning-curtiss            'Binning/Curtiss VTZ'                    VTZ Valence Triple Zeta: 3 Functions/valence AO
vtz_gamess                     'GAMESS VTZ'                             VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
vtz_mclean-chandler            'McLean/Chandler VTZ'                    VTZ Valence Triple Zeta: 3 Functions/Valence AO
vtzp_binning-curtiss           'Binning/Curtiss VTZP'                   VTZP Valence Triple Zeta + Polarization
wachters+f                     'Wachters+f'                             VDZP Valence Double Zeta + Polarization on All Atoms

aug-cc-pvdz_ecp_ncsu           'aug-cc-pvdz ecp ncsu'                  augmented cc-pvDz basis set designed for the NCSU ECP found in https://pseudopotentiallibrary.org/ 
aug-cc-pvtz_ecp_ncsu           'aug-cc-pvtz ecp ncsu'                  augmented cc-pvTz basis set designed for the NCSU ECP found in https://pseudopotentiallibrary.org/ 
aug-cc-pvqz_ecp_ncsu           'aug-cc-pvqz ecp ncsu'                  augmented cc-pvQz basis set designed for the NCSU ECP found in https://pseudopotentiallibrary.org/ 
aug-cc-pv5z_ecp_ncsu           'aug-cc-pv5z ecp ncsu'                  augmented cc-pv5z basis set designed for the NCSU ECP found in https://pseudopotentiallibrary.org/ 
cc-pvdz_ecp_ncsu               'cc-pvdz ecp ncsu'                      cc-pvDz basis set designed for the NCSU ECP found in https://pseudopotentiallibrary.org/ 
cc-pvtz_ecp_ncsu               'cc-pvtz ecp ncsu'                      cc-pvTz basis set designed for the NCSU ECP found in https://pseudopotentiallibrary.org/ 
cc-pvqz_ecp_ncsu               'cc-pvqz ecp ncsu'                      cc-pvQz basis set designed for the NCSU ECP found in https://pseudopotentiallibrary.org/ 
cc-pv5z_ecp_ncsu               'cc-pv5z ecp ncsu'                      cc-pv5z basis set designed for the NCSU ECP found in https://pseudopotentiallibrary.org/ 




# ; vim::nowrap
