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Update issue template to ask for doped and python versions Tests #589: Commit 07e4f21 pushed by kavanase
March 10, 2025 21:47 3h 14m 52s develop
develop
March 10, 2025 21:47 3h 14m 52s
Fix get_neighbour_distances_and_symbols for spaced-out structures a… Tests #588: Commit cf75b38 pushed by kavanase
March 10, 2025 21:28 1h 56m 1s develop
develop
March 10, 2025 21:28 1h 56m 1s
Update dist_tol tests Tests #587: Commit de1baa7 pushed by kavanase
March 6, 2025 04:02 1h 57m 19s develop
develop
March 6, 2025 04:02 1h 57m 19s
Update tutorials Tests #586: Commit 0c5d7c9 pushed by kavanase
March 5, 2025 19:18 3h 40m 48s develop
develop
March 5, 2025 19:18 3h 40m 48s
Add Density of States (DOS) Calculations section to tips Tests #585: Commit 187304b pushed by kavanase
March 5, 2025 19:04 2h 14m 53s develop
develop
March 5, 2025 19:04 2h 14m 53s
Add test_make_molecule_in_a_box Tests #584: Commit a78a7d2 pushed by kavanase
March 4, 2025 21:02 2h 14m 14s develop
develop
March 4, 2025 21:02 2h 14m 14s
fix tiny bug in chemical_potentials (the code was selecting the first… Tests #583: Commit 10e67fc pushed by ireaml
March 4, 2025 16:54 2h 3m 28s develop
develop
March 4, 2025 16:54 2h 3m 28s
Add TODOs for parallelisation with FermiSolver now origin of previo… Tests #582: Commit 12cd866 pushed by kavanase
February 17, 2025 23:46 3h 14m 47s develop
develop
February 17, 2025 23:46 3h 14m 47s
Test link update Tests #581: Commit 39da5ae pushed by kavanase
February 17, 2025 23:30 2h 24m 15s develop
develop
February 17, 2025 23:30 2h 24m 15s
Refactoring Tests #580: Commit 2fe6d19 pushed by kavanase
February 17, 2025 22:20 1h 57m 52s develop
develop
February 17, 2025 22:20 1h 57m 52s
Implement site-competition in DefectThermodynamics & FermiSolver … Tests #579: Commit 4bc8a59 pushed by kavanase
February 10, 2025 19:02 2h 10m 35s develop
develop
February 10, 2025 19:02 2h 10m 35s
Add finally catch to multiprocessing handling Tests #578: Commit b9cb5f4 pushed by kavanase
February 5, 2025 20:33 2h 17m 13s develop
develop
February 5, 2025 20:33 2h 17m 13s
Add context manager for multiprocessing Pool to give informative … Tests #577: Commit 5fab675 pushed by kavanase
February 5, 2025 18:07 2h 11m 37s develop
develop
February 5, 2025 18:07 2h 11m 37s
Minor updates to issue templates Tests #576: Commit 32424cc pushed by kavanase
February 5, 2025 17:17 2h 21m 57s main
main
February 5, 2025 17:17 2h 21m 57s
Add docs mini-section on defects in 2D materials / surface defects Tests #575: Commit 1adfe99 pushed by kavanase
February 3, 2025 23:59 2h 20m 30s develop
develop
February 3, 2025 23:59 2h 20m 30s
Expand charge state guessing function docstrings for more explicit de… Tests #574: Commit 71e7da0 pushed by kavanase
February 2, 2025 21:00 2h 18m 27s develop
develop
February 2, 2025 21:00 2h 18m 27s
Merge branch 'main' into develop Tests #573: Commit 96570f3 pushed by kavanase
January 31, 2025 17:23 2h 17m 52s develop
develop
January 31, 2025 17:23 2h 17m 52s
Delete tests/data/Se_Ext_no_Pnict_Thermo.json.gz Tests #572: Commit b2fa22c pushed by kavanase
January 30, 2025 20:14 3h 40m 34s develop
develop
January 30, 2025 20:14 3h 40m 34s
Delete examples/MgO/CompetingPhases/mgo_chempots.json Tests #571: Commit 0230a95 pushed by kavanase
January 30, 2025 20:14 2h 52m 11s develop
develop
January 30, 2025 20:14 2h 52m 11s
Update docs requirements following renku-sphinx-theme update (SwissDa… Tests #570: Commit a238cdd pushed by kavanase
January 30, 2025 20:11 2h 19m 46s develop
develop
January 30, 2025 20:11 2h 19m 46s
Merge pull request #103 from SMTG-Bham/develop Tests #569: Commit 638f81c pushed by kavanase
January 30, 2025 19:43 2h 18m 8s main
main
January 30, 2025 19:43 2h 18m 8s
Update docs requirements following renku-sphinx-theme update (https… Tests #568: Commit 785e3d2 pushed by kavanase
January 30, 2025 19:42 34m 32s develop
develop
January 30, 2025 19:42 34m 32s
Update docs requirements following renku-sphinx-theme update (https… Tests #567: Commit 8e49f88 pushed by kavanase
January 30, 2025 05:22 2h 18m 11s develop
develop
January 30, 2025 05:22 2h 18m 11s
Merge pull request #103 from SMTG-Bham/develop Tests #566: Commit 35cea11 pushed by kavanase
January 24, 2025 06:41 2h 22m 16s main
main
January 24, 2025 06:41 2h 22m 16s
Allow list input to sort_defect_entries and use in parsing for co… Tests #565: Commit 7d9e324 pushed by kavanase
January 23, 2025 23:55 2h 28m 12s develop
develop
January 23, 2025 23:55 2h 28m 12s