Commits · master · brandimarte / ase · GitLab

Nov 16, 2022
- Merge branch 'read-gpaw-stresses' into 'master' · f785806c
  Jens Jørgen Mortensen authored Nov 16, 2022
  f785806c
- Update gpaw_out.py · 4ca9a9d4
  Anubhab Haldar authored Nov 16, 2022
  
  4ca9a9d4
- Flakes... · 4d93e028
  Anubhab Haldar authored Nov 16, 2022
  
  4d93e028
- Read gpaw stress, add test · 5fb03ba2
  Anubhab Haldar authored Nov 16, 2022
  
  5fb03ba2
Nov 05, 2022
- Merge branch 'fix-line-numbers-in-surface-docs' into 'master' · 02361342
  Ask Hjorth Larsen authored Nov 05, 2022
  02361342
Nov 04, 2022
- Merge branch 'fix-unit-of-magmom' into 'master' · 2c8b9d5a
  Ask Hjorth Larsen authored Nov 04, 2022
  2c8b9d5a
- Fix line numbers in docs · ec14c895
  Jens Jørgen Mortensen authored Nov 04, 2022
  
  ec14c895
Nov 03, 2022
- Use Unicode mu · ada8cd1d
  Jens Jørgen Mortensen authored Nov 03, 2022
  
  ada8cd1d
- Unit of magmom is Bohr magnoton and not au · acc10272
  Jens Jørgen Mortensen authored Nov 03, 2022
  
  acc10272
Nov 02, 2022
- Merge branch 'py-typed' into 'master' · 1ead2862
  Jens Jørgen Mortensen authored Nov 02, 2022
  1ead2862
Oct 26, 2022
- Merge branch 'mysql_port' into 'master' · c1f779a6
  Ask Hjorth Larsen authored Oct 26, 2022
  c1f779a6
- Merge branch 'better_povray_colors' into 'master' · 4cda5ed2
  Ask Hjorth Larsen authored Oct 26, 2022
  4cda5ed2
- Merge branch 'jochym-master-patch-67766' into 'master' · f0266bf4
  Ask Hjorth Larsen authored Oct 26, 2022
  f0266bf4
Oct 25, 2022
- Fix (sub)process attribute (should be process). · 8777ca0a
  Paweł T. Jochym authored Oct 25, 2022
  
  8777ca0a
- failed lint. should be fixed · c355f53c
  Michael Waters authored Oct 25, 2022
  
  c355f53c
- I made a ptable unit test. I hope we don't suddenly discover a bunch of new elements. · 2d5c4655
  Michael Waters authored Oct 25, 2022
  
  2d5c4655
- satisfy linter · 5683b198
  benjaminchen22 authored Oct 25, 2022
  
  5683b198
- fix typo · 91f41d36
  benjaminchen22 authored Oct 25, 2022
  
  91f41d36
- refactor db tests to eliminate duplicate code for getting db name · 79618bc8
  benjaminchen22 authored Oct 25, 2022
  
  79618bc8
- Merge branch 'fix-reduce-lattice' into 'master' · a7e268ac
  Ask Hjorth Larsen authored Oct 25, 2022
  a7e268ac
- Satisfy linter for update test_mysql.py · a696849e
  Benjamin authored Oct 25, 2022
  
  a696849e
Oct 24, 2022
- Update test_sql_db_ext_tables.py to use non-default port of 3307 · 1655b61e
  Benjamin authored Oct 24, 2022
  
  1655b61e
- Update test_db2.py to use non-default port of 3307 · ee1ac82c
  Benjamin authored Oct 24, 2022
  
  ee1ac82c
- Satisfy linter for test_db.py · cd77c4ee
  Benjamin authored Oct 24, 2022
  
  cd77c4ee
- Satisfy linter for test_mysql.py · e28632b7
  Benjamin authored Oct 24, 2022
  
  e28632b7
- Update test_db.py to use non-default port of 3307 · ff226c69
  Benjamin authored Oct 24, 2022
  
  ff226c69
- Fix .gitlab-ci.yml file · f52c79ca
  Benjamin authored Oct 24, 2022
  
  f52c79ca
- Update test_mysql.py to use non-standard port (3307) · 1c5608ff
  Benjamin authored Oct 24, 2022
  
  1c5608ff
- Update .gitlab-ci.yml to use non-standard mysql port (3307) · 67b982bc
  Benjamin authored Oct 24, 2022
  
  67b982bc
- Merge branch 'aims_calculator_command' into 'master' · 350bcb7e
  Ask Hjorth Larsen authored Oct 24, 2022
  350bcb7e
- fix outdated import path in reduce_lattice(). Add unittest of reduce_lattice(). · c83e32e6
  Ask Hjorth Larsen authored Oct 24, 2022
  
  c83e32e6
- Update mysql.py · b2a793cd
  Benjamin authored Oct 24, 2022
  
  b2a793cd
Oct 22, 2022
- Keeping the branch fresh · 7aab614e
  Michael Waters authored Oct 21, 2022
  7aab614e
- More style clean-up. · aa031e2c
  Michael Waters authored Oct 21, 2022
  
  aa031e2c
Oct 21, 2022
- More style clean up. · caf19a3e
  Michael Waters authored Oct 21, 2022
  
  caf19a3e
- Code style clean up. · 4c738a9d
  Michael Waters authored Oct 21, 2022
  
  4c738a9d
Oct 19, 2022
- Convert a string argv into a list command for AimsProfile · f0f72fcc
  Thomas Purcell authored Oct 19, 2022
  f0f72fcc
- Remove trailing whitespace · 4fd10693
  Thomas Purcell authored Oct 19, 2022
  4fd10693
- Fix lint error · 548a617e
  Thomas Purcell authored Oct 19, 2022
  548a617e
- Restore `run_command` and `ASE_AIMS_COMMAND` functoniality · 9ff80b44
  Thomas Purcell authored Oct 19, 2022
  9ff80b44