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Add Mt_Gemm for the nonlocal_pw #6253

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Merged
merged 5 commits into from
Jun 7, 2025
Merged

Add Mt_Gemm for the nonlocal_pw #6253

merged 5 commits into from
Jun 7, 2025

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@A-006
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@A-006 A-006 commented May 31, 2025

What's changed?

  • Changed the LCAO basis type to single precision for the test in the file.
  • The nonlocal_pw implementation has now been added with DSP support for computation. However, there is an error in the mt_fft_device.dat when computing multiple matrices. As a temporary solution, we have added a Gemm (matrix multiplication) routine, and the results will be tested once the bug is fixed.

mohanchen
mohanchen reviewed May 31, 2025
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@mohanchen mohanchen merged commit 2b1e662 into deepmodeling:develop Jun 7, 2025
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@mohanchen mohanchen added GPU & DCU & HPC GPU and DCU and HPC related any issues Refactor Refactor ABACUS codes Features Needed The features are indeed needed, and developers should have sophisticated knowledge labels Jun 7, 2025
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Features Needed The features are indeed needed, and developers should have sophisticated knowledge GPU & DCU & HPC GPU and DCU and HPC related any issues Refactor Refactor ABACUS codes

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