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Pull requests: deepmodeling/abacus-develop
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Refactor: Remove global dependence of descriptor, orbital_precalc, v_delta_precalc in DeePKS.
#5808
opened Jan 4, 2025 by
ErjieWu
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Refactor:Remove Ucell::update_pos_taud
The Absolute Zero
Reduce the "entropy" of the code to 0
#5794
opened Jan 2, 2025 by
A-006
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Feature: Support machine-learning based kinetic energy density functional for OFDFT
Compile & CICD & Docs & Dependencies
Issues related to compiling ABACUS
Features Needed
The features are indeed needed, and developers should have sophisticated knowledge
#5777
opened Dec 27, 2024 by
sunliang98
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3 of 7 tasks
RT-TDDFT GPU Acceleration (Phase 2): Adding needed BLAS and LAPACK support for The features are indeed needed, and developers should have sophisticated knowledge
GPU & DCU & HPC
GPU and DCU and HPC related any issues
Tensor on CPU and refactoring linear algebra operations in TDDFT
Features Needed
#5773
opened Dec 26, 2024 by
AsTonyshment
•
Draft
feature: parallel solve subspace diagonalization in dav_subspace
Diago
Issues related to diagonalizaiton methods
#5549
opened Nov 21, 2024 by
pxlxingliang
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4 tasks
A noncollinear functional ensemble based on multi-collinear approach
Features Needed
The features are indeed needed, and developers should have sophisticated knowledge
#5542
opened Nov 20, 2024 by
YuleZhang936
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