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886 workflow run results
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add RDMFT(Reduced Density Matrix Functional Theory) code （Useful Information: for those who what to contribute codes to ABACUS, this is a good example) CUDA Test #3870: Pull request #5325 synchronize by JGHan7
22m 41s JGHan7:rdmft_PR
JGHan7:rdmft_PR
22m 41s
Update mult_psi_dmr.cpp CUDA Test #3869: Pull request #5552 opened by mohanchen
9m 39s mohanchen-patch-9
mohanchen-patch-9
9m 39s
Update init_orb.cpp CUDA Test #3868: Pull request #5551 opened by mohanchen
25m 21s mohanchen-patch-8
mohanchen-patch-8
25m 21s
Update gint_gamma.h CUDA Test #3867: Pull request #5550 opened by mohanchen
11m 17s mohanchen-patch-7
mohanchen-patch-7
11m 17s
feature: parallel solve subspace diagonalization in dav_subspace CUDA Test #3866: Pull request #5549 synchronize by pre-commit-ci-lite bot
10m 0s pxlxingliang:diag
pxlxingliang:diag
10m 0s
feature: parallel solve subspace diagonalization in dav_subspace CUDA Test #3865: Pull request #5549 opened by pxlxingliang
18m 21s pxlxingliang:diag
pxlxingliang:diag
18m 21s
Refactor: remove init_after_vc CUDA Test #3864: Pull request #5547 opened by YuLiu98
22m 34s YuLiu98:refactor
YuLiu98:refactor
22m 34s
add RDMFT(Reduced Density Matrix Functional Theory) code （Useful Information: for those who what to contribute codes to ABACUS, this is a good example) CUDA Test #3862: Pull request #5325 synchronize by JGHan7
23m 4s JGHan7:rdmft_PR
JGHan7:rdmft_PR
23m 4s
Refactor atom_input and unify the fake atom data structure of grid and atom_input CUDA Test #3861: Pull request #5546 synchronize by pre-commit-ci-lite bot
15m 25s goodchong:neighbor_atom
goodchong:neighbor_atom
15m 25s
Refactor atom_input and unify the fake atom data structure of grid and atom_input CUDA Test #3860: Pull request #5546 synchronize by goodchong
15m 25s goodchong:neighbor_atom
goodchong:neighbor_atom
15m 25s
Refactor atom_input and unify the fake atom data structure of grid and atom_input CUDA Test #3859: Pull request #5546 opened by goodchong
15m 47s goodchong:neighbor_atom
goodchong:neighbor_atom
15m 47s
fix bug: change Mixing_Data::length from int to size_t CUDA Test #3858: Pull request #5545 synchronize by linpeize
14m 5s linpeize:Mixing_Data_length_size_t
linpeize:Mixing_Data_length_size_t
14m 5s
Test: delete threshold files in the examples with warnings and update the result.ref files CUDA Test #3856: Pull request #5402 synchronize by WHUweiqingzhou
10m 26s WHUweiqingzhou:test
WHUweiqingzhou:test
10m 26s
Refactor: replace raw pointers to vector in atom_spec.h CUDA Test #3855: Pull request #5521 synchronize by pre-commit-ci-lite bot
12m 26s dyzheng:refactor_spin
dyzheng:refactor_spin
12m 26s
Refactor: move wfinit to module_psi CUDA Test #3854: Pull request #5544 opened by haozhihan
8m 16s haozhihan:guess
haozhihan:guess
8m 16s
A noncollinear functional ensemble based on multi-collinear approach CUDA Test #3853: Pull request #5542 synchronize by YuleZhang936
9m 39s YuleZhang936:mc
YuleZhang936:mc
9m 39s
Refactor: refactor paw code in hsolver-pw CUDA Test #3852: Pull request #5543 synchronize by haozhihan
9m 40s haozhihan:hsolver-pw
haozhihan:hsolver-pw
9m 40s
Refactor: refactor paw code in hsolver-pw CUDA Test #3851: Pull request #5543 synchronize by haozhihan
9m 48s haozhihan:hsolver-pw
haozhihan:hsolver-pw
9m 48s
Refactor: refactor paw code in hsolver-pw CUDA Test #3850: Pull request #5543 opened by haozhihan
13m 2s haozhihan:hsolver-pw
haozhihan:hsolver-pw
13m 2s
A noncollinear functional ensemble based on multi-collinear approach CUDA Test #3849: Pull request #5542 synchronize by jinzx10
22m 0s YuleZhang936:mc
YuleZhang936:mc
22m 0s
Fix: recover the use of -1 value of out_chg CUDA Test #3848: Pull request #5540 opened by kirk0830
9m 41s kirk0830-patch-1
kirk0830-patch-1
9m 41s
Refactor: replace raw pointers to vector in atom_spec.h CUDA Test #3846: Pull request #5521 synchronize by dyzheng
13m 50s dyzheng:refactor_spin
dyzheng:refactor_spin
13m 50s
Test: delete threshold files in the examples with warnings and update the result.ref files CUDA Test #3845: Pull request #5402 synchronize by WHUweiqingzhou
9m 38s WHUweiqingzhou:test
WHUweiqingzhou:test
9m 38s
Implement a new BFGS optimizer, used for geometry relaxation CUDA Test #3844: Pull request #5467 synchronize by 19hello
10m 43s 19hello:mybfgs
19hello:mybfgs
10m 43s
Test: correct the INPUT of examples/scf/lcao_Cu and the reference of examples/bsse/water CUDA Test #3843: Pull request #5536 synchronize by kirk0830
19m 22s pxlxingliang:example
pxlxingliang:example
19m 22s