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3-21g
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
4-31g
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Documentation in configure
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6-31++g
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Documentation in configure
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6-31++g_star
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Documentation in configure
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6-31++g_star_star
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Documentation in configure
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6-31+g
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6-31+g_star
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Documentation in configure
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6-31g
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6-31g_3df_3pd
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
6-31g_star
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6-311++g_2d_2p
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Documentation in configure
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6-311++g_3df_3pd
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Documentation in configure
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6-311++g_star_star
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Documentation in configure
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6-311+g_star
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Documentation in configure
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6-311g
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6-311g_2df_2pd
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
6-311G_star
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
6-311G_star_star
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
00_README.rst
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
ano2_ames
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
ano_ames
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
ano-pvdz_ecp_bfd
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Initial commit
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2019-01-25 11:39:31 +01:00 |
ano-pvqz_ecp_bfd
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Initial commit
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2019-01-25 11:39:31 +01:00 |
ano-pvtz_ecp_bfd
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Initial commit
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2019-01-25 11:39:31 +01:00 |
ano-rcc
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
apr-cc-pv_q+d_z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-ano-pvdz_roos
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Initial commit
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2019-01-25 11:39:31 +01:00 |
aug-ano-pvtz_roos
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Initial commit
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2019-01-25 11:39:31 +01:00 |
aug-cc-pcv5z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pcvdz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pcvqz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pcvtz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pv5z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pv5z_ecp_bfd
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Initial commit
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2019-01-25 11:39:31 +01:00 |
aug-cc-pv5z_ecp_ncsu
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NCSU ECP and Basis set (#41)
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2019-05-24 16:19:34 -05:00 |
aug-cc-pv6z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pvdz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pvdz_ecp_bfd
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Initial commit
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2019-01-25 11:39:31 +01:00 |
aug-cc-pvdz_ecp_ncsu
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NCSU ECP and Basis set (#41)
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2019-05-24 16:19:34 -05:00 |
aug-cc-pvqz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pvqz_ecp_bfd
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Initial commit
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2019-01-25 11:39:31 +01:00 |
aug-cc-pvqz_ecp_ncsu
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NCSU ECP and Basis set (#41)
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2019-05-24 16:19:34 -05:00 |
aug-cc-pvtz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pvtz_ecp_bfd
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Initial commit
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2019-01-25 11:39:31 +01:00 |
aug-cc-pvtz_ecp_ncsu
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NCSU ECP and Basis set (#41)
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2019-05-24 16:19:34 -05:00 |
aug-cc-pwcv5z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pwcvdz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pwcvqz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
aug-cc-pwcvtz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pcv5z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pcvdz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pcvqz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pcvtz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pv5z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pv6z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pv8z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pv9z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pvdz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pvdz_ecp_bfd
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Initial commit
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2019-01-25 11:39:31 +01:00 |
cc-pvdz_ecp_ncsu
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Merge branch 'Fix_Bug_ECP' of https://github.com/anbenali/qp2 into anbenali-Fix_Bug_ECP
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2019-06-08 15:52:33 +02:00 |
cc-pvqz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pvqz_ecp_bfd
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Initial commit
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2019-01-25 11:39:31 +01:00 |
cc-pvqz_ecp_ncsu
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Merge branch 'Fix_Bug_ECP' of https://github.com/anbenali/qp2 into anbenali-Fix_Bug_ECP
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2019-06-08 15:52:33 +02:00 |
cc-pvtz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pvtz_ecp_bfd
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Initial commit
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2019-01-25 11:39:31 +01:00 |
cc-pvtz_ecp_ncsu
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Merge branch 'Fix_Bug_ECP' of https://github.com/anbenali/qp2 into anbenali-Fix_Bug_ECP
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2019-06-08 15:52:33 +02:00 |
cc-pwcv5z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pwcvdz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pwcvqz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
cc-pwcvtz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
chipman-dzp
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Initial commit
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2019-01-25 11:39:31 +01:00 |
chipman-dzp+diffuse
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Initial commit
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2019-01-25 11:39:31 +01:00 |
d-aug-cc-pv5z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
d-aug-cc-pv6z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
d-aug-cc-pvdz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
d-aug-cc-pvqz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
d-aug-cc-pvtz
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
def2-qzvp
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
def2-qzvpd
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
def2-qzvpp
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
def2-qzvppd
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
def2-sv_p
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
def2-svp
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
def2-svpd
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Documentation in configure
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def2-tzvp
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
def2-tzvpd
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
def2-tzvpp
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
def2-tzvppd
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
install.py
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
jul-cc-pv_d+d_z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
jul-cc-pv_q+d_z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
jul-cc-pv_t+d_z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
jun-cc-pv_d+d_z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
jun-cc-pv_q+d_z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
jun-cc-pv_t+d_z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
lanl08
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
lanl08+
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
lanl08d
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
lanl08f
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
m6-31g
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
may-cc-pv_q+d_z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
may-cc-pv_t+d_z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
midi_bang
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
midi_huzinaga
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
mini
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
pv6z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
pv7z
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
pvdz_ahlrichs
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
sto-2g
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
sto-3g
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
sto-3g_star
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
sto-4g
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
sto-5g
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |
sto-6g
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Documentation in configure
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2020-02-04 19:04:36 +01:00 |