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Created with Raphaël 2.2.017Mar1514131211108643227Feb26252419181716151413121110654331Jan3029282322212018171614109876543231Dec30292827262322201918171613121112111011109854329Nov2622201918171615141312111098654231Oct302925242322212017161513121198429Sep28272624171613tentatively remove provisions for warningspass maxsplit by name. Positional passing is deprecatedalways show why tests were skipped, if skippeddo not attempt spglib in bleeding-edge (although having that would be useful)use PYTEST_ADDOPTS to unduplicate some optionsmake bleeding-edge more bleeding-edgeMerge branch 'enable-ci-cache' into 'master'changelog entrysplit more jobs into before_script and after_script and remove some legacy warning protectionsstop doctesting phasediagram, it is deprecated anyway and the warning is complicated to handleattempt to enable individual caches for each kind of ci jobmove installation to before_scriptremove provisions for old pytest-xdistuse CI/PIP cache with oldlibs and explicitly install and pin dependenciesdo not automatically use more than 8 workersfix the toggles and drop downsbootstrap-updat…bootstrap-update-5.3.2fix landing page update to bootstrap 5EAM stress test for all input file typesMerge branch 'add-writing-scriv' into 'master'DOC: Add contribution guidelines for ``scriv`` for writing changelogFix stress for non-3D, removed 'stresses' propertyFix lint errorspyfhiaims-io-pr…pyfhiaims-io-processingFix calculator-lite errorsFix lint errorThis should fix remaining errorscheck for pyfhiaims in io format testsAdd aims optional dependencysetup tests with importorskip for pyfhiaimsFinal changes before beta release of pyfhiaimsupdate IO to use converters in pyfhi-aimsUse new parsersFix errors from ruffUpdate interface to use pyfhiaimsSet stdout for io calculation in FHI-aimsaims_socket_std…aims_socket_std_ioAdd file to `changelog.d`fix-1455fix-1455Convert hash (triple bond) to hex for URLMerge branch 'refactor-pubchem-tests' into 'master'MAINT: Refactor tests for `ase.data.pubchem` using pytest `monkeypatch`Merge branch 'write-castep-geom-md' into 'master'MAINT: Add `write_castep_geom` and `write_castep_md` etc.