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TDRCC2 test deprecated. #87

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haakoek opened this issue Aug 16, 2022 · 1 comment
Open

TDRCC2 test deprecated. #87

haakoek opened this issue Aug 16, 2022 · 1 comment
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@haakoek
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haakoek commented Aug 16, 2022

The current TDRCC2 test is deprecated after the missing terms to the lambda1-equations were added.
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Schoyen commented Aug 22, 2022

As 762db72 fails, this test should be updated ASAP.

@haakoek haakoek self-assigned this Aug 22, 2022
Schoyen added a commit that referenced this issue Aug 23, 2022
@Schoyen
Skip failing TDRCC2 test
df7c540 
    This is done while #87 is an issue.
Schoyen added a commit that referenced this issue Aug 23, 2022
@haakoek @Schoyen
Use systems compute_reference_energy when evaluating the ccsd energy. (…
1346bb4 
…#88)

* Use systems compute_reference_energy which includes the nuclear repulsion energy.

* Skip failing TDRCC2 test

    This is done while #87 is an issue.

Co-authored-by: Øyvind Sigmundson Schøyen <[email protected]>
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@haakoek @Schoyen