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Update the default libcint version CI #3190: Commit e6e5b75 pushed by sunqm
August 18, 2025 16:29 2h 18m 32s master
master
August 18, 2025 16:29 2h 18m 32s
Dump chkfile for 1e system (fix #2912) CI #3189: Commit ca343ce pushed by sunqm
August 18, 2025 16:28 2h 21m 40s master
master
August 18, 2025 16:28 2h 21m 40s
Small bug fix CI #3188: Pull request #2944 opened by JangidBhavnesh
August 17, 2025 23:47 2h 20m 24s JangidBhavnesh:master
JangidBhavnesh:master
August 17, 2025 23:47 2h 20m 24s
Dump chkfile for 1e system CI #3187: Pull request #2943 opened by sunqm
August 17, 2025 22:05 2h 19m 5s sunqm:2912
sunqm:2912
August 17, 2025 22:05 2h 19m 5s
Remove the misleading warning for exp_to_discard CI #3186: Pull request #2941 opened by sunqm
August 17, 2025 21:51 2h 18m 49s sunqm:2921
sunqm:2921
August 17, 2025 21:51 2h 18m 49s
Update the default libcint version CI #3185: Pull request #2940 opened by sunqm
August 17, 2025 17:18 1h 55m 10s sunqm:libcint-version-update
sunqm:libcint-version-update
August 17, 2025 17:18 1h 55m 10s
Fix Cell.KRKS instantiation for symmetry adapted k-points CI #3184: Pull request #2929 synchronize by sunqm
August 14, 2025 22:24 2h 19m 3s sunqm:cell-methods
sunqm:cell-methods
August 14, 2025 22:24 2h 19m 3s
Stress tensor CI #3183: Pull request #2934 synchronize by sunqm
August 14, 2025 22:15 9m 22s sunqm:stress-tensor
sunqm:stress-tensor
August 14, 2025 22:15 9m 22s
Fix Cell.KRKS instantiation for symmetry adapted k-points CI #3182: Pull request #2929 synchronize by sunqm
August 14, 2025 19:45 2h 18m 41s sunqm:cell-methods
sunqm:cell-methods
August 14, 2025 19:45 2h 18m 41s
Analytical gradients for DFT+U methods CI #3181: Pull request #2899 synchronize by sunqm
August 14, 2025 00:29 2h 20m 33s sunqm:dft+u_grad
sunqm:dft+u_grad
August 14, 2025 00:29 2h 20m 33s
Fix Cell.KRKS instantiation for symmetry adapted k-points CI #3180: Pull request #2929 synchronize by sunqm
August 14, 2025 00:23 2h 14m 32s sunqm:cell-methods
sunqm:cell-methods
August 14, 2025 00:23 2h 14m 32s
Fix Cell.KRKS instantiation for symmetry adapted k-points CI #3179: Pull request #2929 synchronize by sunqm
August 14, 2025 00:21 2m 28s sunqm:cell-methods
sunqm:cell-methods
August 14, 2025 00:21 2m 28s
Fix Cell.KRKS instantiation for symmetry adapted k-points CI #3178: Pull request #2929 synchronize by sunqm
August 14, 2025 00:21 44s sunqm:cell-methods
sunqm:cell-methods
August 14, 2025 00:21 44s
Fix Cell.KRKS instantiation for symmetry adapted k-points CI #3177: Pull request #2929 synchronize by sunqm
August 14, 2025 00:20 1m 51s sunqm:cell-methods
sunqm:cell-methods
August 14, 2025 00:20 1m 51s
Return converged==False is extra cycle failed CI #3176: Commit fafef00 pushed by sunqm
August 13, 2025 16:11 2h 40m 32s master
master
August 13, 2025 16:11 2h 40m 32s
fix typo CI #3175: Commit 76096b7 pushed by sunqm
August 13, 2025 16:10 2h 17m 31s master
master
August 13, 2025 16:10 2h 17m 31s
fix typo CI #3174: Pull request #2937 opened by fishjojo
August 13, 2025 05:39 2h 18m 39s fishjojo-patch-1
fishjojo-patch-1
August 13, 2025 05:39 2h 18m 39s
fix typo CI #3173: Commit 71d3003 pushed by fishjojo
August 13, 2025 05:39 2h 18m 21s fishjojo-patch-1
fishjojo-patch-1
August 13, 2025 05:39 2h 18m 21s
Minor bug fix: Return converged==False if SCF extra cycle failed CI #3172: Pull request #2936 opened by henryw7
August 13, 2025 02:59 2h 19m 24s henryw7:scf_extra_cycle_false
henryw7:scf_extra_cycle_false
August 13, 2025 02:59 2h 19m 24s
Fix Cell.KRKS instantiation for symmetry adapted k-points CI #3171: Pull request #2929 synchronize by sunqm
August 12, 2025 21:53 2h 15m 7s sunqm:cell-methods
sunqm:cell-methods
August 12, 2025 21:53 2h 15m 7s
Update ASE interface to support lattice relaxation CI #3170: Pull request #2935 opened by sunqm
August 12, 2025 21:52 2h 16m 53s sunqm:ase-calculator
sunqm:ase-calculator
August 12, 2025 21:52 2h 16m 53s
Stress tensor CI #3169: Pull request #2934 opened by sunqm
August 12, 2025 21:50 2h 16m 23s sunqm:stress-tensor
sunqm:stress-tensor
August 12, 2025 21:50 2h 16m 23s
Print imaginary frequency as negative frequency in dump_normal_mode() CI #3168: Commit 9e95a66 pushed by sunqm
August 12, 2025 21:48 2h 16m 18s master
master
August 12, 2025 21:48 2h 16m 18s
Print imaginary frequency as negative frequency in dump_normal_mode() CI #3167: Pull request #2933 opened by henryw7
August 12, 2025 18:46 2h 24m 2s henryw7:thermo_print_imaginary
henryw7:thermo_print_imaginary
August 12, 2025 18:46 2h 24m 2s
Fix RHF exchange performance by preserving MO information (#2930) CI #3166: Commit d415b65 pushed by sunqm
August 12, 2025 14:34 2h 22m 14s master
master
August 12, 2025 14:34 2h 22m 14s