feat: atom_ener in energy fitting #3370
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Signed-off-by: Jinzhe Zeng <jinzhe.zeng@rutgers.edu>
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| @@ -79,6 +83,7 @@ | |||
| precision, | |||
| mixed_types, | |||
| numb_fparam, | |||
| atom_ener, | |||
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Unused local variable Note test
Codecov ReportAttention: Patch coverage is
Additional details and impacted files@@ Coverage Diff @@
## devel #3370 +/- ##
==========================================
+ Coverage 76.06% 76.08% +0.02%
==========================================
Files 421 421
Lines 35514 35540 +26
Branches 1618 1618
==========================================
+ Hits 27013 27040 +27
+ Misses 7633 7632 -1
Partials 868 868 ☔ View full report in Codecov by Sentry. |
Signed-off-by: Jinzhe Zeng <jinzhe.zeng@rutgers.edu>
wanghan-iapcm
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Mar 1, 2024
njzjz
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Mar 1, 2024
Co-authored-by: Han Wang <92130845+wanghan-iapcm@users.noreply.github.com> Signed-off-by: Jinzhe Zeng <jinzhe.zeng@rutgers.edu>
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It should be merged after #3370. Signed-off-by: Jinzhe Zeng <jinzhe.zeng@rutgers.edu>
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Also, fix the TF serialization issue (it tried to store a tensor instead of a NumPy array).