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Fix: md restart can not read STRU #5215

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Merged
merged 7 commits into from
Oct 12, 2024
Merged

Fix: md restart can not read STRU #5215

merged 7 commits into from
Oct 12, 2024

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@YuLiu98
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@YuLiu98 YuLiu98 commented Oct 11, 2024

What's changed?

  • fix a bug that md restart can not read STRU.
  • move some print func to Module_IO.
  • rename conv_elec to conv_esolver

@YuLiu98 YuLiu98 requested a review from Qianruipku October 11, 2024 08:54
@mohanchen mohanchen added the The Absolute Zero Reduce the "entropy" of the code to 0 label Oct 12, 2024
@mohanchen mohanchen merged commit 49d6afa into deepmodeling:develop Oct 12, 2024
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@YuLiu98 YuLiu98 mentioned this pull request Oct 20, 2024
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@YuLiu98 YuLiu98 deleted the esolver branch October 28, 2024 02:20
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@mohanchen mohanchen mohanchen approved these changes

@Qianruipku Qianruipku Awaiting requested review from Qianruipku

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@YuLiu98 @mohanchen