| .. |
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2zapa-nr
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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2zapa-nr-cv
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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3-21++g
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basis
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2020-01-17 13:57:03 +01:00 |
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3-21++g_star
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basis
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2020-01-17 13:57:03 +01:00 |
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3-21g
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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3-21g_star
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basis
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2020-01-17 13:57:03 +01:00 |
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3-21gsp
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basis
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2020-01-17 13:57:03 +01:00 |
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3zapa-nr
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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3zapa-nr-cv
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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4-22gsp
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basis
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2020-01-17 13:57:03 +01:00 |
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4-31g
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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4zapa-nr
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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4zapa-nr-cv
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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5zapa-nr
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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5zapa-nr-cv
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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5zp
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basis
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2020-01-17 13:57:03 +01:00 |
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6-31++g
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-31++g_star
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-31++g_star_star
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-31+g
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-31+g_star
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-31g
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-31g_3df_3pd
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-31g_star
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-31g_star_star
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-31g_star-Blaudeau
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basis
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2020-01-17 13:57:03 +01:00 |
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6-31g-Blaudeau
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basis
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2020-01-17 13:57:03 +01:00 |
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6-311++g_2d_2p
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-311++g_3df_3pd
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-311++g_star_star
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-311+g_star
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-311g
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-311g_2df_2pd
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-311G_star
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6-311G_star_star
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6zapa-nr
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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6zp
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basis
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2020-01-17 13:57:03 +01:00 |
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7zapa-nr
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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00_README.rst
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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ano2_ames
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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ano_ames
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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ano_bauschlicher
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basis
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2020-01-17 13:57:03 +01:00 |
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ano-pvdz_ecp_bfd
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basis
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2020-01-17 13:57:03 +01:00 |
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ano-pvqz_ecp_bfd
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basis
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2020-01-17 13:57:03 +01:00 |
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ano-pvtz_ecp_bfd
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basis
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2020-01-17 13:57:03 +01:00 |
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ano-rcc
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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apr-cc-pv_q+d_z
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-5zp
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basis
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2020-01-17 13:57:03 +01:00 |
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aug-ano-pvdz_roos
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basis
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2020-01-17 13:57:03 +01:00 |
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aug-ano-pvtz_roos
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basis
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2020-01-17 13:57:03 +01:00 |
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aug-cc-pcv5z
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pcv5z_ecp_ccecp
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pcv_t+d_z
|
basis
|
2020-01-17 13:57:03 +01:00 |
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aug-cc-pcvdz
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pcvdz_ecp_ccecp
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pcvqz
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pcvqz_ecp_ccecp
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pcvtz
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pcvtz_ecp_ccecp
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pv5z
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pv5z_ecp_bfd
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basis
|
2020-01-17 13:57:03 +01:00 |
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aug-cc-pv5z_ecp_ccecp
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pv5z_ecp_ncsu
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basis
|
2020-01-17 13:57:03 +01:00 |
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aug-cc-pv5z-pp
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basis
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2020-01-17 13:57:03 +01:00 |
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aug-cc-pv6z
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pv_5+d_z
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basis
|
2020-01-17 13:57:03 +01:00 |
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aug-cc-pv_6+d_z
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basis
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2020-01-17 13:57:03 +01:00 |
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aug-cc-pv_d+d_z
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basis
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2020-01-17 13:57:03 +01:00 |
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aug-cc-pv_q+d_z
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basis
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2020-01-17 13:57:03 +01:00 |
|
aug-cc-pv_t+d_z
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basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvdz
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pvdz_ecp_bfd
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basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvdz_ecp_ccecp
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pvdz_ecp_ncsu
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basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvdz-pp
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basis
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2020-01-17 13:57:03 +01:00 |
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aug-cc-pvqz
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
|
aug-cc-pvqz_ecp_bfd
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvqz_ecp_ccecp
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
|
aug-cc-pvqz_ecp_ncsu
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basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvqz_sbd
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basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvqz-nr
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basis
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2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvqz-pp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvtz
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
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aug-cc-pvtz_ecp_bfd
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvtz_ecp_ccecp
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
|
aug-cc-pvtz_ecp_ncsu
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basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvtz_sbd
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basis
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2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvtz-nr
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basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvtz-pp
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basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pvtz.native
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clean up
|
2020-10-14 23:31:14 +02:00 |
|
aug-cc-pwcv5z
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
|
aug-cc-pwcv5z-nr
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pwcvdz
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clean up basis sets
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2020-10-26 14:52:11 +01:00 |
|
aug-cc-pwcvqz
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clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
aug-cc-pwcvqz-nr
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-cc-pwcvtz
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clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
aug-cc-pwcvtz-nr
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-dzp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-mcc-pv8z
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clean up
|
2020-10-06 14:28:52 +02:00 |
|
aug-pc-0
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pc-1
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pc-2
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pc-3
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pc-4
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcj-0
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcj-0_2006
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcj-1
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcj-1_2006
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcj-2
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcj-2_2006
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcj-3
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcj-3_2006
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcj-4
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcj-4_2006
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcs-2
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcs-3
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcs-4
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcS-0
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcS-1
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcseg-0
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcseg-1
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcseg-2
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcseg-3
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcseg-4
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcsseg-0
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcsseg-1
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcsseg-2
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcsseg-3
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pcsseg-4
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-pv7z
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-qzp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
aug-tzp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pcv5z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pcv5z0
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pcv5z_ames
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pcv5z_ecp_ccecp
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pcv6z
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pcvdz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pcvdz_ecp_ccecp
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pcvqz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pcvqz_ames
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pcvqz_ecp_ccecp
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pcvtz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pcvtz_ames
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pcvtz_ecp_ccecp
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pv5z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pv5z_ames
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pv5z_ecp_bfd
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pv5z_ecp_ccecp
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pv5z_ecp_ncsu
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pv5z-nr
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pv5z-pp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pv6z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pv8z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pv9z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pv_5+d_z
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pv_6+d_z
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pv_d+d_z
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pv_q+d_z
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pv_t+d_z
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pv_t+d_z+
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvdz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pvdz_ecp_bfd
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvdz_ecp_ccecp
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pvdz_ecp_ncsu
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvdz-pp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvqz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pvqz_ames
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvqz_ecp_bfd
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvqz_ecp_ccecp
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pvqz_ecp_ncsu
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvqz_sdb
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvqz-nr
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvqz-pp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvtz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pvtz_ames
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvtz_ecp_bfd
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvtz_ecp_ccecp
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pvtz_ecp_ncsu
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvtz_sdb
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvtz-nr
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvtz-pp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pvtz+
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pwcv5z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pwcv5z-nr
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pwcv5z-pp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pwcvdz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pwcvdz-pp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pwcvqz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pwcvqz-nr
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pwcvqz-pp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
cc-pwcvtz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
cc-pwcvtz-nr
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
chipman-dzp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
chipman-dzp+diffuse
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
d-aug-cc-pv5z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
d-aug-cc-pv6z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
d-aug-cc-pvdz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
d-aug-cc-pvqz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
d-aug-cc-pvtz
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
def2-qzvp
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
def2-qzvpd
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
def2-qzvpp
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
def2-qzvppd
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
def2-sv_p
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
def2-svp
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
def2-svpd
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
def2-tzvp
|
clean up QuAcK
|
2022-11-08 15:38:46 +01:00 |
|
def2-tzvpd
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
def2-tzvpp
|
clean up QuAcK
|
2022-11-08 15:38:46 +01:00 |
|
def2-tzvppd
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
dunning_tz
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
dz_dunning
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
dz_dunning-hay
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
dzp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
dzp_dunning
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
dzpd_dunning
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
dzpr_dunning
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
dzq
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
dzr_dunning
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
dzvp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
dzvp2
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
ecp10mdf
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
ecp60mdf
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
iglo-ii
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
iglo-iii
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
install.py
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
jul-cc-pv_d+d_z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
jul-cc-pv_q+d_z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
jul-cc-pv_t+d_z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
jun-cc-pv_d+d_z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
jun-cc-pv_q+d_z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
jun-cc-pv_t+d_z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
lanl2dz_ecp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
lanl2dz_mod
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
lanl2dzdp_ecp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
lanl2tz
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
lanl2tz+
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
lanl2tzf
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
lanl08
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
lanl08+
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
lanl08d
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
lanl08f
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
m6-31g
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
maug-cc-pv_d+d_z
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
maug-cc-pv_q+d_z
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
maug-cc-pv_t+d_z
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
maug-cc-pvdz
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
maug-cc-pvqz
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
maug-cc-pvtz
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
may-cc-pv_q+d_z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
may-cc-pv_t+d_z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
mb_ecp_hay-wadt
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
mg3s
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
midi_bang
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
midi_huzinaga
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
mini
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
mini_huzinaga
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
pv6z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
pv7z
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
pvdz_ahlrichs
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
pvtz_gamess
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
pvtz_sadlej
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
qzp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
rlc_ecp_stuttgart
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
rsc_ano_ecp_stuttgart
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
rsc_ecp_stuttgart
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
sadlej+
|
clean up
|
2020-10-06 14:28:52 +02:00 |
|
sbkjc_p_2d
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
sto-2g
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
sto-3g
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
sto-3g_star
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
sto-4g
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
sto-5g
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
sto-6g
|
clean up basis sets
|
2020-10-26 14:52:11 +01:00 |
|
sto-6g_star
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
sv_binning-curtiss
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
sv_dunning-hay
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
svp_binning-curtiss
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
svp_dunning-hay
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
svpd_dunning-hay
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
svpdr
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
svpr_dunning-hay
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
svr_dunning-hay
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
svrr_dunning-hay
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
tzp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
tzv_ahlrichs
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
tzvp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
ugbs
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
uncontracted_1_partridge
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
uncontracted_2_partridge
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
uncontracted_3_partridge
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
uncontracted_4_partridge
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
vdz_ahlrichs
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
vdz_ecp_hay-wadt
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
vdz_sbkjc_ecp
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
vtz_ahlrichs
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
vtz_binning-curtiss
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
vtz_gamess
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
vtz_mclean-chandler
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
vtzp_binning-curtiss
|
basis
|
2020-01-17 13:57:03 +01:00 |
|
wachters+f
|
basis
|
2020-01-17 13:57:03 +01:00 |
