Branches

• change-write_espresso_ph

  189d6f17 · Added a blank line · Mar 19, 2025
  ase/ase!3626
• master default protected

  8ec52db2 · Added wrappers to read_espresso_ph and write_espresso_ph · Mar 19, 2025
  ase/ase!3632
• speckhard/exciting_calculate

  5ce25546 · Fix the calculate method for exciting, and read results on the template. · Mar 13, 2025
• bootstrap-update-5.3.2

  52a79040 · fix the toggles and drop downs · Mar 13, 2025
• pyfhiaims-io-processing

  3c00b22d · Fix lint errors · Mar 11, 2025
• aims_socket_std_io

  225be3c3 · Set stdout for io calculation in FHI-aims · Mar 10, 2025
• fix-1455

  0fa8b49e · Add file to `changelog.d` · Mar 10, 2025
• read_output_ORCA

  14a17454 · ruff format · Mar 10, 2025
• add-mattersim

  1fe15718 · Added MACE calculator · Mar 08, 2025
• supercell_3d_defects

  035b58c8 · Added target_length parameter · Mar 03, 2025
• shake-fixinternals

  b96c9700 · Merge branch 'master' of gitlab.com:ase/ase into shake-fixinternals · Feb 27, 2025
• 1634-profiles-mangle-command-lines-on-windows

  716db12c · Merge branch 'castep-xc' into 'master' · Feb 26, 2025
• do-not-rotate-cell

  aaec2d1a · Use polar decomposition to not rotate cell when applying a filter. · Feb 14, 2025
• calculator-plugins

  f2f690d2 · Ruff format · Feb 14, 2025
• iocontext-del

  09ee8fdb · avoid leak in test. Not sure how well the GUI itself guards against leaks · Feb 14, 2025
• bussi-parinello

  dfb55f7f · safer test · Jan 23, 2025
• espresso_io_refactor

  bdc14b7a · backward compatibility with old numpys · Jan 22, 2025
• plugin-experiment

  85c51b12 · Merge branch 'master' into plugin-experiment · Jan 18, 2025
• new_logger

  09b47074 · fix failing tests · Jan 18, 2025
• moderate-single-point-calculator

  dc600f53 · Accept properties in `all_outputs` · Jan 16, 2025