Skip to content

Actions: grimme-lab/dxtb

Tests (Ubuntu, no libcint)

Actions

Loading...
Loading

Show workflow options

Create status badge

Loading
36 workflow runs
36 workflow runs

Filter by Event

Filter by Status

Filter by Branch

Filter by Actor

Bump version to 0.1.1 (#182)
Tests (Ubuntu, no libcint) #36: Commit 2a8b622 pushed by marvinfriede
October 21, 2024 16:08 52m 9s main
October 21, 2024 16:08 52m 9s
Bump version to 0.1.1
Tests (Ubuntu, no libcint) #35: Pull request #182 opened by marvinfriede
October 21, 2024 15:53 55m 10s bump-version-011
October 21, 2024 15:53 55m 10s
Fix batched charges (#180)
Tests (Ubuntu, no libcint) #34: Commit 769e78a pushed by marvinfriede
October 21, 2024 15:50 22m 40s main
October 21, 2024 15:50 22m 40s
Pytorch 2.5.0
Tests (Ubuntu, no libcint) #33: Pull request #181 opened by marvinfriede
October 21, 2024 15:44 26m 26s pytorch-250
October 21, 2024 15:44 26m 26s
Fix batched charges
Tests (Ubuntu, no libcint) #32: Pull request #180 opened by marvinfriede
October 20, 2024 17:38 6m 22s charge-batched
October 20, 2024 17:38 6m 22s
[pre-commit.ci] pre-commit autoupdate (#178)
Tests (Ubuntu, no libcint) #31: Commit 5ecb578 pushed by marvinfriede
October 15, 2024 12:38 6m 8s main
October 15, 2024 12:38 6m 8s
[pre-commit.ci] pre-commit autoupdate
Tests (Ubuntu, no libcint) #30: Pull request #178 opened by pre-commit-ci bot
October 14, 2024 20:19 6m 23s pre-commit-ci-update-config
October 14, 2024 20:19 6m 23s
[pre-commit.ci] pre-commit autoupdate (#177)
Tests (Ubuntu, no libcint) #29: Commit 9598d7c pushed by marvinfriede
October 7, 2024 21:43 16m 9s main
October 7, 2024 21:43 16m 9s
[pre-commit.ci] pre-commit autoupdate
Tests (Ubuntu, no libcint) #28: Pull request #177 opened by pre-commit-ci bot
October 7, 2024 21:04 6m 4s pre-commit-ci-update-config
October 7, 2024 21:04 6m 4s
Improve deletion of timer
Tests (Ubuntu, no libcint) #27: Pull request #176 opened by marvinfriede
September 30, 2024 21:48 4m 24s timer
September 30, 2024 21:48 4m 24s
Add example for challenging SCF convergence (#173)
Tests (Ubuntu, no libcint) #26: Commit a1e87b0 pushed by marvinfriede
September 24, 2024 21:23 4m 20s main
September 24, 2024 21:23 4m 20s
Add example for challenging SCF convergence
Tests (Ubuntu, no libcint) #25: Pull request #173 synchronize by marvinfriede
September 24, 2024 19:47 4m 17s issue-123
September 24, 2024 19:47 4m 17s
Add example for challenging SCF convergence
Tests (Ubuntu, no libcint) #24: Pull request #173 opened by marvinfriede
September 24, 2024 14:24 11m 15s issue-123
September 24, 2024 14:24 11m 15s
Support Python 3.12 (#172)
Tests (Ubuntu, no libcint) #23: Commit 9c4af05 pushed by marvinfriede
September 19, 2024 19:18 4m 15s main
September 19, 2024 19:18 4m 15s
Support Python 3.12
Tests (Ubuntu, no libcint) #22: Pull request #172 synchronize by marvinfriede
September 19, 2024 18:47 4m 14s py312
September 19, 2024 18:47 4m 14s
Support Python 3.12
Tests (Ubuntu, no libcint) #21: Pull request #172 synchronize by marvinfriede
September 19, 2024 17:05 7m 52s py312
September 19, 2024 17:05 7m 52s
Support Python 3.12
Tests (Ubuntu, no libcint) #20: Pull request #172 opened by marvinfriede
September 19, 2024 16:54 9m 36s py312
September 19, 2024 16:54 9m 36s
Support PyTorch 2.4.1 (#171)
Tests (Ubuntu, no libcint) #19: Commit 74fc34c pushed by marvinfriede
September 19, 2024 02:25 3m 48s main
September 19, 2024 02:25 3m 48s
Support PyTorch 2.4.1
Tests (Ubuntu, no libcint) #18: Pull request #171 opened by marvinfriede
September 19, 2024 02:08 3m 55s pytorch-241
September 19, 2024 02:08 3m 55s
Update conda availability (#170)
Tests (Ubuntu, no libcint) #17: Commit 3f04d40 pushed by marvinfriede
September 18, 2024 18:23 26m 3s main
September 18, 2024 18:23 26m 3s
Update conda availability
Tests (Ubuntu, no libcint) #16: Pull request #170 opened by marvinfriede
September 18, 2024 18:23 10m 21s readme-update
September 18, 2024 18:23 10m 21s
Bump version to 0.1.0 (#169)
Tests (Ubuntu, no libcint) #15: Commit bd962cf pushed by marvinfriede
September 18, 2024 13:39 18m 17s main
September 18, 2024 13:39 18m 17s
Bump version to 0.1.0
Tests (Ubuntu, no libcint) #14: Pull request #169 opened by marvinfriede
September 18, 2024 13:05 22m 15s bump-version-010
September 18, 2024 13:05 22m 15s
Fix docs and consistency checks in calculator getters (#168)
Tests (Ubuntu, no libcint) #13: Commit 29724b7 pushed by marvinfriede
September 18, 2024 12:48 5m 27s main
September 18, 2024 12:48 5m 27s
Fix docs and consistency checks in calculator getters
Tests (Ubuntu, no libcint) #12: Pull request #168 synchronize by marvinfriede
September 18, 2024 04:10 33m 25s readme-update
September 18, 2024 04:10 33m 25s