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Refactor energy-density matrix in RT-TDDFT to replace raw ScaLAPACK and BLAS calls with ScalapackConnector and BlasConnector interfaces #6687

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Merged
merged 1 commit into from
Nov 6, 2025
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Refactor energy-density matrix in RT-TDDFT to replace raw ScaLAPACK and BLAS calls with ScalapackConnector and BlasConnector interfaces #6687

merged 1 commit into from
Nov 6, 2025

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@AsTonyshment AsTonyshment commented Nov 6, 2025

What's changed?

  • Refactor energy-density matrix in RT-TDDFT to replace raw ScaLAPACK and BLAS calls with ScalapackConnector and BlasConnector interfaces

@AsTonyshment
Refactor cal_edm_tddft to replace raw ScaLAPACK and BLAS calls with S…
f51e6c1 
…calapackConnector and BlasConnector interfaces
mohanchen
mohanchen approved these changes Nov 6, 2025
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LGTM

@mohanchen mohanchen added Refactor Refactor ABACUS codes The Absolute Zero Reduce the "entropy" of the code to 0 labels Nov 6, 2025
@mohanchen mohanchen merged commit 46bc1a4 into deepmodeling:develop Nov 6, 2025
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@AsTonyshment AsTonyshment deleted the td_edm_scalapack_connector branch November 7, 2025 07:53
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Refactor Refactor ABACUS codes The Absolute Zero Reduce the "entropy" of the code to 0

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