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Merge pull request #348 from libAtoms/err_calc_stress_virial_voigt publish to pypi #163: Commit c1f3bad pushed by bernstei
December 4, 2024 22:00 19s main
main
December 4, 2024 22:00 19s
Merge pull request #348 from libAtoms/err_calc_stress_virial_voigt Build docs #307: Commit c1f3bad pushed by bernstei
December 4, 2024 22:00 1s main
main
December 4, 2024 22:00 1s
Convert virial/stress to Voigt-6 when computing error table Python Package and tests #880: Pull request #348 synchronize by bernstei
December 4, 2024 20:15 1h 1m 50s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 4, 2024 20:15 1h 1m 50s
Convert virial/stress to Voigt-6 when computing error table Build docs #306: Pull request #348 synchronize by bernstei
December 4, 2024 20:15 1s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 4, 2024 20:15 1s
Try to fix mkl-service / numpy / pytorch threading issue publish to pypi #162: Commit 19f30be pushed by bernstei
December 4, 2024 20:15 18s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 4, 2024 20:15 18s
Convert virial/stress to Voigt-6 when computing error table Build docs #305: Pull request #348 synchronize by bernstei
December 4, 2024 19:11 1s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 4, 2024 19:11 1s
Convert virial/stress to Voigt-6 when computing error table Python Package and tests #879: Pull request #348 synchronize by bernstei
December 4, 2024 19:11 57m 20s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 4, 2024 19:11 57m 20s
force numpy < 2 in conda install xtb, to avoid breaking compatibility publish to pypi #161: Commit 73ac18a pushed by bernstei
December 4, 2024 19:11 24s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 4, 2024 19:11 24s
Convert virial/stress to Voigt-6 when computing error table Build docs #304: Pull request #348 synchronize by bernstei
December 4, 2024 14:12 1s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 4, 2024 14:12 1s
Convert virial/stress to Voigt-6 when computing error table Python Package and tests #878: Pull request #348 synchronize by bernstei
December 4, 2024 14:12 59m 50s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 4, 2024 14:12 59m 50s
track numpy version in github CI pytests workflow publish to pypi #160: Commit a420119 pushed by bernstei
December 4, 2024 14:12 22s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 4, 2024 14:12 22s
Convert virial/stress to Voigt-6 when computing error table Build docs #303: Pull request #348 synchronize by bernstei
December 3, 2024 22:17 1s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 3, 2024 22:17 1s
Convert virial/stress to Voigt-6 when computing error table Python Package and tests #877: Pull request #348 synchronize by bernstei
December 3, 2024 22:17 59m 11s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 3, 2024 22:17 59m 11s
Increase github CI pytest python version to 3.10, to work with MACE publish to pypi #159: Commit 9e3ae93 pushed by bernstei
December 3, 2024 22:17 23s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 3, 2024 22:17 23s
Convert virial/stress to Voigt-6 when computing error table Build docs #302: Pull request #348 synchronize by bernstei
December 3, 2024 17:57 1s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 3, 2024 17:57 1s
Convert virial/stress to Voigt-6 when computing error table Python Package and tests #876: Pull request #348 synchronize by bernstei
December 3, 2024 17:57 56m 17s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 3, 2024 17:57 56m 17s
Switch pytests to mopac from github, since openmopac.net drops older … publish to pypi #158: Commit c1b6f67 pushed by bernstei
December 3, 2024 17:57 20s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 3, 2024 17:57 20s
Convert virial/stress to Voigt-6 when computing error table Python Package and tests #875: Pull request #348 opened by bernstei
December 3, 2024 16:55 9m 19s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 3, 2024 16:55 9m 19s
Convert virial/stress to Voigt-6 when computing error table Build docs #301: Pull request #348 opened by bernstei
December 3, 2024 16:55 2s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 3, 2024 16:55 2s
Make sure copying data in error calc doesn't break when data is missing publish to pypi #157: Commit 10898b2 pushed by bernstei
December 3, 2024 16:21 21s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 3, 2024 16:21 21s
reshape stress/virial to voigt-6 in error calc publish to pypi #156: Commit ae6718c pushed by bernstei
December 3, 2024 15:39 29s err_calc_stress_virial_voigt
err_calc_stress_virial_voigt
December 3, 2024 15:39 29s
Fix default MD logger header prefix Build docs #300: Commit 5b08766 pushed by bernstei
November 1, 2024 17:17 1s main
main
November 1, 2024 17:17 1s
Fix default MD logger header prefix publish to pypi #155: Commit 5b08766 pushed by bernstei
November 1, 2024 17:17 23s main
main
November 1, 2024 17:17 23s
more verbose error messages from md publish to pypi #154: Commit e534acb pushed by bernstei
October 31, 2024 16:33 25s main
main
October 31, 2024 16:33 25s
more verbose error messages from md Build docs #299: Commit e534acb pushed by bernstei
October 31, 2024 16:33 1s main
main
October 31, 2024 16:33 1s