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fix-1600
591b9db5
·
Update `changelog.d`
·
Mar 22, 2025
master
default
protected
490f509e
·
Merge branch 'fix-lint' into 'master'
·
Mar 21, 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
add-to-dict-to-calculators
959fa464
·
Treat `calcs` and `weights` as `parameters`
·
Jan 09, 2025
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