update after commit aec40a5d35 to use only i<j pairs [ci skip]

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Apra, Edoardo 2023-07-20 10:33:41 -07:00

parent 759dc9e9ce

commit 5b5f3429d7

1 changed files with 1080 additions and 1348 deletions

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QA/tests/prop_cg_nh3_b3lyp/prop_cg_nh3_b3lyp.out

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