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Fixed memory leaks and output bugs according to #6515 and #6518. (#6585) Container #2900: Commit 4ad2b02 pushed by dyzheng
42m 50s LTS
LTS
42m 50s
Modify bfgs test code (#6575) Container #2899: Commit c66790b pushed by mohanchen
55m 12s develop
develop
55m 12s
Use namespace instead of class for LapackConnector, remove lapack_wra… Container #2898: Commit e7ee599 pushed by mohanchen
19m 48s develop
develop
19m 48s
Update version.h (#6580) Container #2897: Commit 1f0618f pushed by Critsium-xy
44m 32s v3.9.0.16
v3.9.0.16
44m 32s
Update version.h (#6580) Container #2896: Commit 1f0618f pushed by mohanchen
3h 20m 19s develop
develop
3h 20m 19s
The United Connector of LAPACK (#6579) Container #2895: Commit 265dac7 pushed by mohanchen
1h 38m 15s develop
develop
1h 38m 15s
fix: the Nan value when rho is negative in ELF (#6574) Container #2894: Commit 9cc2775 pushed by dyzheng
1h 19m 37s LTS
LTS
1h 19m 37s
Update DeePKS and do some reconstructions (#6576) Container #2893: Commit 757bb58 pushed by mohanchen
1h 4m 49s develop
develop
1h 4m 49s
[Fix] Fix problems in the latest develop version causing compilation … Container #2892: Commit 57ea55d pushed by mohanchen
40m 41s develop
develop
40m 41s
Fixed DFT-1/2 memory bug and added integration testing for DFT-1/2. (… Container #2891: Commit 1f7e8fb pushed by mohanchen
19m 54s develop
develop
19m 54s
Fix: stress error with nscf (#6556) Container #2890: Commit 2e51b4d pushed by dyzheng
33m 19s LTS
LTS
33m 19s
Clean and Reconstruct ESolver --- 3rd time (#6567) Container #2889: Commit d9ac0c6 pushed by mohanchen
1h 9m 13s develop
develop
1h 9m 13s
Fix: reorder after_scf() call in after_opt() (#6570) Container #2888: Commit 39d1383 pushed by mohanchen
53m 41s develop
develop
53m 41s
Make ESolver simpler again (#6565) Container #2887: Commit 79b2508 pushed by mohanchen
20m 9s develop
develop
20m 9s
Feature: add ABFS_ORBITAL and ABFS_JLES_ORBITAL in class `Exx_Opt… Container #2886: Commit 8ea1821 pushed by mohanchen
45m 20s develop
develop
45m 20s
Make Esolver simpler (#6557) Container #2885: Commit 59973ea pushed by mohanchen
19m 29s develop
develop
19m 29s
Fix: EXX PW GPU (#6564) Container #2884: Commit a9ac67f pushed by mohanchen
36m 8s develop
develop
36m 8s
change BFGS name and make lattice_change_cg and ions_move_cg shorter … Container #2883: Commit bf4ce74 pushed by mohanchen
19m 56s develop
develop
19m 56s
Performance: Optimizing EXX PW memory usage by calculating potential … Container #2882: Commit 2f10362 pushed by mohanchen
36m 4s develop
develop
36m 4s
Fix: Fix the errors in building abacus with libtorch-gpu (#6554) Container #2881: Commit 04b2922 pushed by mohanchen
18m 29s develop
develop
18m 29s
Add subspace diagonalization for orthogonal input (#6559) Container #2880: Commit 5411878 pushed by mohanchen
49m 19s develop
develop
49m 19s
Fix the errors related to the "atomicAdd" function when building with… Container #2879: Commit ae3fdf9 pushed by mohanchen
20m 29s develop
develop
20m 29s
Removed the temporary variable hr_Gint_full_ when transitioning from … Container #2878: Commit e6a55ed pushed by dyzheng
50m 40s develop
develop
50m 40s
cherry-pick #6233: Resolve MPI communication issue (R coordinate mism… Container #2877: Commit 74304f8 pushed by dyzheng
17m 15s LTS
LTS
17m 15s
Fix: DFT+U nscf calculation of nspin=1 and output onsite.dm with out_… Container #2876: Commit 4722169 pushed by dyzheng
26m 0s LTS
LTS
26m 0s