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Pull requests: deepmodeling/abacus-develop

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Pull requests list

Feature: enable scalapcack solver for LR-TDDFT EXX and lr-TDDFT Related to EXX or lr-TDDFT Refactor Refactor ABACUS codes
#5867 opened Jan 16, 2025 by maki49 Loading…
1
Refactor: refactor npol, constructors and int *ngk of Psi class
#5863 opened Jan 16, 2025 by haozhihan • Draft
[Refactor] Remove all ctx parameters in memory operators GPU & DCU & HPC GPU and DCU and HPC related any issues Refactor Refactor ABACUS codes The Absolute Zero Reduce the "entropy" of the code to 0
#5862 opened Jan 16, 2025 by Critsium-xy Loading…
5
Fix: Output a warning when the lattice vector is left-handed. Features Needed The features are indeed needed, and developers should have sophisticated knowledge Refactor Refactor ABACUS codes
#5855 opened Jan 13, 2025 by sunliang98 Loading…
4 tasks
1
1
RT-TDDFT GPU Acceleration: RT-TD now has preliminary support for GPU computation Features Needed The features are indeed needed, and developers should have sophisticated knowledge GPU & DCU & HPC GPU and DCU and HPC related any issues
#5773 opened Dec 26, 2024 by AsTonyshment Loading…
9
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 Loading…
10
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