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eric-features
NWChem
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QA
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tests
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bsse_scf_optim
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Huub Van Dam
179e2274c8
HvD: Like in bsse_dft_trimer test case this test case also generated results
...
contain NaN for some of the centers of mass. This check in eliminates that issue.
2011-05-19 23:48:23 +00:00
..
bsse_scf_optim.nw
BSSE Task level code from
2006-12-01 22:19:20 +00:00
bsse_scf_optim.out
HvD: Like in bsse_dft_trimer test case this test case also generated results
2011-05-19 23:48:23 +00:00