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mirror of https://github.com/LCPQ/quantum_package synced 2024-11-05 05:33:56 +01:00
quantum_package/data/basis
2018-07-24 17:59:14 +02:00
..
6-31+g Added 6-31g+ 2018-07-17 14:42:15 +02:00
aug-cc-pcv5z Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
aug-cc-pcvdz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
aug-cc-pcvqz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
aug-cc-pcvtz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
aug-cc-pv5z Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
aug-cc-pv6z Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
aug-cc-pvdz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
aug-cc-pvqz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
aug-cc-pvtz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
av5z-bfd Added AVnZ-BFD 2018-03-14 10:09:09 +01:00
avdz-bfd Added AVnZ-BFD 2018-03-14 10:09:09 +01:00
avqz-bfd Added AVnZ-BFD 2018-03-14 10:09:09 +01:00
avtz-bfd Added AVnZ-BFD 2018-03-14 10:09:09 +01:00
cc-pcv5z Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
cc-pcv6z Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
cc-pcvdz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
cc-pcvqz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
cc-pcvtz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
cc-pv5z Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
cc-pv6z Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
cc-pvdz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
cc-pvqz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
cc-pvtz Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
chipman-dzp Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
ncsu-vdz Save MRCC WF 2018-07-24 17:59:14 +02:00
ncsu-vtz Save MRCC WF 2018-07-24 17:59:14 +02:00
v5z-bfd Fixed bug 2017-06-19 11:14:03 +02:00
vdz-ano-bfd Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
vdz-bfd Fixed bug 2017-06-19 11:14:03 +02:00
vqz-ano-bfd Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
vqz-bfd Fixed bug 2017-06-19 11:14:03 +02:00
vtz-ano-bfd Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
vtz-bfd Fixed bug 2017-06-19 11:14:03 +02:00