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IR intensities may produce stars Close Stale #473: Issue #1174 labeled by foxtran
February 4, 2025 01:48 2s
February 4, 2025 01:48 2s
Close Stale Close Stale #472: Scheduled
February 4, 2025 00:17 2s main
main
February 4, 2025 00:17 2s
Close Stale Close Stale #471: Scheduled
February 3, 2025 00:18 2s main
main
February 3, 2025 00:18 2s
Close Stale Close Stale #470: Scheduled
February 2, 2025 00:19 2s main
main
February 2, 2025 00:19 2s
Fix xtb/docking test CI #1637: Pull request #1173 opened by foxtran
February 1, 2025 13:48 7m 52s foxtran:fix/docking-test
foxtran:fix/docking-test
February 1, 2025 13:48 7m 52s
Accept any length symbols' strings CI #1636: Pull request #1172 opened by foxtran
February 1, 2025 12:54 7m 45s foxtran:patch-3
foxtran:patch-3
February 1, 2025 12:54 7m 45s
Fix L-BFGS memory accesses CI #1635: Pull request #1171 opened by foxtran
February 1, 2025 12:19 7m 42s foxtran:fix/l-bfgs-memory-access
foxtran:fix/l-bfgs-memory-access
February 1, 2025 12:19 7m 42s
Fix division by zero at geoopt CI #1634: Pull request #1170 opened by foxtran
February 1, 2025 11:28 7m 32s foxtran:fix/div_by_zero_at_geoopt
foxtran:fix/div_by_zero_at_geoopt
February 1, 2025 11:28 7m 32s
Number of electrons can be large than number of orbitals (or equal) Close Stale #469: Issue #1169 labeled by foxtran
February 1, 2025 10:34 1s
February 1, 2025 10:34 1s
Fix exit condition in calc_distances CI #1633: Pull request #1168 opened by foxtran
February 1, 2025 03:48 7m 52s foxtran:patch-1
foxtran:patch-1
February 1, 2025 03:48 7m 52s
Fix multiple open of xtbscreen.xyz in local.f90 (xtb/iff test) CI #1632: Pull request #1167 opened by foxtran
February 1, 2025 03:04 7m 47s foxtran:fix/multiple_open
foxtran:fix/multiple_open
February 1, 2025 03:04 7m 47s
Fix double print of ancopt header CI #1631: Pull request #1166 opened by foxtran
February 1, 2025 02:06 8m 4s foxtran:fix/ancopt_double_print
foxtran:fix/ancopt_double_print
February 1, 2025 02:06 8m 4s
Fix ubuntu-latest CI and introduce Arm validation CI #1630: Pull request #1165 synchronize by foxtran
February 1, 2025 00:49 7m 53s foxtran:fix/CI
foxtran:fix/CI
February 1, 2025 00:49 7m 53s
Fix ubuntu-latest CI and introduce Arm validation CI #1629: Pull request #1165 synchronize by foxtran
February 1, 2025 00:37 10m 38s foxtran:fix/CI
foxtran:fix/CI
February 1, 2025 00:37 10m 38s
Fix ubuntu-latest CI and introduce Arm validation CI #1628: Pull request #1165 synchronize by foxtran
February 1, 2025 00:35 11m 19s foxtran:fix/CI
foxtran:fix/CI
February 1, 2025 00:35 11m 19s
Fix ubuntu-latest CI and introduce Arm validation CI #1627: Pull request #1165 synchronize by foxtran
February 1, 2025 00:33 9m 49s foxtran:fix/CI
foxtran:fix/CI
February 1, 2025 00:33 9m 49s
Fix ubuntu-latest CI and introduce Arm validation CI #1626: Pull request #1165 synchronize by foxtran
February 1, 2025 00:32 7m 53s foxtran:fix/CI
foxtran:fix/CI
February 1, 2025 00:32 7m 53s
Fix ubuntu-latest CI and introduce Arm validation CI #1625: Pull request #1165 synchronize by foxtran
February 1, 2025 00:28 8m 35s foxtran:fix/CI
foxtran:fix/CI
February 1, 2025 00:28 8m 35s
Close Stale Close Stale #468: Scheduled
February 1, 2025 00:19 2s main
main
February 1, 2025 00:19 2s
Fix ubuntu-latest CI and introduce Arm validation CI #1624: Pull request #1165 synchronize by foxtran
February 1, 2025 00:17 11m 52s foxtran:fix/CI
foxtran:fix/CI
February 1, 2025 00:17 11m 52s
Fix ubuntu-latest CI and introduce Arm validation CI #1623: Pull request #1165 opened by foxtran
February 1, 2025 00:16 9m 2s foxtran:fix/CI
foxtran:fix/CI
February 1, 2025 00:16 9m 2s
Different energies and structures for same input with fixed atoms Close Stale #467: Issue #1164 labeled by markus-hermann
January 31, 2025 17:43 2s
January 31, 2025 17:43 2s
Close Stale Close Stale #466: Scheduled
January 31, 2025 00:17 2s main
main
January 31, 2025 00:17 2s
ddCOSMO Surface Area Incorrect Close Stale #465: Issue #1163 labeled by lukaswittmann
January 30, 2025 15:36 2s
January 30, 2025 15:36 2s
Close Stale Close Stale #464: Scheduled
January 30, 2025 00:17 2s main
main
January 30, 2025 00:17 2s