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@maki49 maki49 commented Nov 12, 2025

Fix a wrong usage of Veff that acts spin0 potential to spin1 result.
Thanks @AroundPeking for finding the bug.

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maki49 commented Nov 12, 2025

The test failure is irrelevant to this fix.
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@mohanchen mohanchen added Refactor Refactor ABACUS codes Bugs Bugs that only solvable with sufficient knowledge of DFT and removed Refactor Refactor ABACUS codes labels Nov 13, 2025
@dyzheng dyzheng merged commit e98850a into deepmodeling:LTS Nov 13, 2025
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maki49 added a commit to maki49/abacus-develop that referenced this pull request Nov 17, 2025
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Bugs Bugs that only solvable with sufficient knowledge of DFT Refactor Refactor ABACUS codes

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3 participants