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Example for dp2.x_lmp_gaussian #873

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Example for dp2.x_lmp_gaussian #873

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ziqi-hu
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@ziqi-hu ziqi-hu commented Aug 15, 2022

An example.

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codecov-commenter commented Aug 16, 2022

Codecov Report

Merging #873 (ff3435a) into devel (8dea29e) will increase coverage by 2.88%.
The diff coverage is n/a.

@@            Coverage Diff             @@
##            devel     #873      +/-   ##
==========================================
+ Coverage   35.13%   38.02%   +2.88%     
==========================================
  Files          96       99       +3     
  Lines       16804    17759     +955     
==========================================
+ Hits         5904     6752     +848     
- Misses      10900    11007     +107     
Impacted Files Coverage Δ
dpgen/generator/lib/make_calypso.py 70.06% <0.00%> (-7.46%) ⬇️
dpgen/generator/run.py 62.50% <0.00%> (-1.18%) ⬇️
dpgen/data/gen.py 47.88% <0.00%> (-0.60%) ⬇️
dpgen/simplify/simplify.py 0.00% <0.00%> (ø)
dpgen/generator/lib/run_calypso.py 10.00% <0.00%> (ø)
dpgen/generator/lib/calypso_run_opt.py 0.00% <0.00%> (ø)
dpgen/generator/lib/calypso_check_outcar.py 0.00% <0.00%> (ø)
dpgen/generator/lib/calypso_run_model_devi.py 0.00% <0.00%> (ø)
dpgen/auto_test/Gamma.py 62.84% <0.00%> (ø)
dpgen/auto_test/ABACUS.py 79.35% <0.00%> (ø)
... and 18 more

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@njzjz
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njzjz commented Aug 16, 2022

After #870 and #874 are merged, this PR should follow the same way to check arguments. We don't want to manually review it.

@ziqi-hu ziqi-hu closed this by deleting the head repository Aug 18, 2022
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3 participants