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Pull requests: deepmodeling/abacus-develop

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Pull requests list

Feature: add out_mat_ds to print <phi|dphi> matrix Features Needed The features are indeed needed, and developers should have sophisticated knowledge Refactor Refactor ABACUS codes
#6149 opened Apr 14, 2025 by dyzheng Loading…
4 tasks
1
1
Refactor: move init_mixing to before_scf The Absolute Zero Reduce the "entropy" of the code to 0
#6147 opened Apr 13, 2025 by YuLiu98 Loading…
Test: Add unit tests and integrate tests for new features of DeePKS. DeePKS Issues related to the DeePKS Refactor Refactor ABACUS codes Unit Tests/Integreate Tests Issues/PR related to unit tests and integrate tests
#6140 opened Apr 11, 2025 by ErjieWu Loading…
1
2
Feature: cusolver support for LCAO kpar Features Needed The features are indeed needed, and developers should have sophisticated knowledge Refactor Refactor ABACUS codes
#6139 opened Apr 11, 2025 by dzzz2001 Loading…
4
Resolve the segmentation fault occurring in the pw float implementation
#6130 opened Apr 8, 2025 by A-006 Loading…
1
6
Fix: add MPI_Finalize in QUIT function
#6089 opened Apr 1, 2025 by Critsium-xy • Draft
Add Gtest for GPU pw_basis and pw_basis_k Features Needed The features are indeed needed, and developers should have sophisticated knowledge Unit Tests/Integreate Tests Issues/PR related to unit tests and integrate tests
#6087 opened Apr 1, 2025 by A-006 Loading…
14
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