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benchmark_plots
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precommit: Update Python packages and re-format
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2026-02-24 17:11:52 +01:00 |
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build_utils
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precommit: Update Python packages and re-format
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2026-02-24 17:11:52 +01:00 |
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conventions
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Precommit: check for CPASSERT(.FALSE.), and empty CPABORT() (#5491)
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2026-07-03 12:09:01 +02:00 |
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coverage
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Reformat with black 23.3.0
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2023-05-02 12:31:58 +02:00 |
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cubecruncher
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Write cube values with explicit three-digit exponents (#5245)
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2026-05-19 05:38:47 +02:00 |
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dashboard
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Use pdbg for Rawhide tester (#5419)
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2026-06-22 13:28:55 +02:00 |
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docker
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PR for adding libGint to CP2K (#5446)
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2026-07-02 14:30:11 +02:00 |
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doxify
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"Make it nice": GFN2-xTB (#5162)
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2026-05-10 01:34:44 +02:00 |
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f77_interface
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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fedora
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RPM-build: Temporarily disable SMM backend until LibXS is provided in Fedora repo (#5373)
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2026-06-08 17:47:24 +02:00 |
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Fun2D
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precommit: Add simple Makefile formatter
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2022-02-07 10:02:03 +01:00 |
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hfx_tools
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Fix various shellcheck warnings
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2022-01-28 11:55:35 +01:00 |
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input_editing
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Introduce @FFTYPE directive
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2024-01-15 23:09:52 +01:00 |
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libint
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Toolchain: Avoid additional dependencies of libint and rollback COSMA upgrade (#5072)
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2026-04-18 18:17:31 +02:00 |
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logo
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Reformat with black 23.3.0
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2023-05-02 12:31:58 +02:00 |
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maple2f90
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Python: PEP8 fixes (#1926)
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2022-02-03 11:35:01 +01:00 |
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minimax_tools
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update to 2026
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2026-01-01 16:06:41 +01:00 |
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pao-ml
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Docker: Upgrade python packages (#5172)
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2026-05-12 13:31:01 +02:00 |
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precommit
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Precommit: check for CPASSERT(.FALSE.), and empty CPABORT() (#5491)
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2026-07-03 12:09:01 +02:00 |
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regtesting
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Fix Wannier90 k-point export path for symmetry-reconstructed SCF MOs (#5233)
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2026-05-17 22:20:32 +02:00 |
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scriptmini
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Fix typo
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2020-03-12 16:48:53 +01:00 |
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spack
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pytorch 2.12.0 -> 2.12.1 (#5507)
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2026-07-02 12:20:55 +02:00 |
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toolchain
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Set OpenMPI default binding policy to none via environment variable (#5511)
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2026-07-02 16:08:38 +02:00 |
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vibronic_spec
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Docker: Upgrade python packages (#5172)
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2026-05-12 13:31:01 +02:00 |
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diff_cp2k.py
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Updated tools/diff_cp2k.py (#3926)
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2025-01-31 11:12:04 +01:00 |
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fix_unused_public.py
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Reformat with black 23.3.0
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2023-05-02 12:31:58 +02:00 |
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pre-commit-install.sh
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pre-commit-install: fix install of golang shfmt pre-commit hook
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2021-08-02 17:23:13 +02:00 |
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rixs_postprocess.py
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Resonant Inelastic X-ray Spectroscopy (RIXS) Module
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2025-07-22 16:39:38 +02:00 |
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trajana.f90
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Remove tabs and trailing spaces
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2021-03-11 20:06:46 +01:00 |
