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Fix #6572

Unit Tests and/or Case Tests for my changes

  • A unit test is still need to added for bug fix.

@mohanchen mohanchen added Bugs Bugs that only solvable with sufficient knowledge of DFT Refactor Refactor ABACUS codes labels Oct 12, 2025
@mohanchen mohanchen merged commit 487555c into deepmodeling:develop Oct 12, 2025
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Bugs Bugs that only solvable with sufficient knowledge of DFT Refactor Refactor ABACUS codes

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[Tests] Some tests are failed in 04_DPLJ\09_DeePKS\16_SDFT_GPU

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