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edoapra 2024-11-07 15:55:28 -08:00
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commit 7f01184b62
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QA/tests/et_zn_dimer/et_zn_dimer.nw
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@ -44,8 +44,7 @@ geometry zn_r5
end
basis "ao basis" spherical
Zn1 library "ahlrichs vdz"
Zn2 library "ahlrichs vdz"
zn library "ahlrichs vdz"
end
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QA/tests/et_zn_dimer/et_zn_dimer.out
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