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support electronic tempeture data used in simplify; refactor post_fp_vasp #1329

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merged 4 commits into from
Sep 11, 2023

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@njzjz njzjz commented Sep 9, 2023

Fix #1303.

@njzjz njzjz linked an issue Sep 9, 2023 that may be closed by this pull request
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codecov bot commented Sep 9, 2023

Codecov Report

Patch coverage: 60.00% and project coverage change: -0.03% ⚠️

Comparison is base (beee7ef) 48.56% compared to head (aec086f) 48.54%.

❗ Current head aec086f differs from pull request most recent head 55154de. Consider uploading reports for the commit 55154de to get more accurate results

Additional details and impacted files
@@            Coverage Diff             @@
##            devel    #1329      +/-   ##
==========================================
- Coverage   48.56%   48.54%   -0.03%     
==========================================
  Files          82       82              
  Lines       14645    14658      +13     
==========================================
+ Hits         7112     7115       +3     
- Misses       7533     7543      +10     
Files Changed Coverage Δ
dpgen/simplify/simplify.py 46.09% <0.00%> (-0.63%) ⬇️
dpgen/generator/run.py 67.41% <58.82%> (-0.18%) ⬇️
dpgen/util.py 94.17% <100.00%> (+0.49%) ⬆️

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@wanghan-iapcm wanghan-iapcm merged commit 32ce9bf into deepmodeling:devel Sep 11, 2023
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[BUG] _dpgen simplify with fparam
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