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Created with Raphaël 2.2.029Oct14Sep111019Aug414Jul20Mar199Jan4Mar129Jan20Jul131Mar13Feb129626Oct11Aug23Mar2Nov130Sep2622191213Jul865428Jun27262524232122May17229Apr211230Mar23Feb13Jan18DecRemoved unecessary symlink.mastermasterFixed undefined eFermi variable and lint issuesFurther update of README.md; mv metadata.yml -> metadata.yamlUpdated README.md; added metadata.yml; the lead branch is now master, inactive branches became tagsFermi energy: fixed bug on unopened section_single_configuration_calculationFermi energy: added capability to parse from static/infodirty commit. I am moving files to new installationParser optimizations.Remove dependency on old metainfo.Added metainfo python code.Try to find non mainfiles in more directories.legacy-metainfolegacy-metainfoRelexed handling of decoding errors while reading all files in directory.Fixed metainfo path calculations.Nomad-fairdmeta 2.0 changesnomad-coenomad-coeMerge branch 'auto-license-info' into 'master'Added copyright statements and license.include name and email addresspreMetaRenamepreMetaRenameremove other unused moduleadd license headersadd LICENSE filemore cleanupclean up extraneous code which is not used for parsingclean up vestigial code from certain octopus parser modules, moving the remainder into the main moduleinclude new testsadd test outputs corresponding to newer octopusnew Fe test for devel versionfix bad variable nameget labels correctlyattempt to handle units correctlyget coordinates from parser log, or from coordinates file taken from parser log. Get cell from static/info if it is listedlicense header for scala filesfix handling of complex numbersfix typotry to represent basis set correctlyapparently, sometimes some quantities like spacing are not written to the parser log. Thus, use the parser log to override spacing only when possible.1.1.01.1.0ignore metadata that cannot be converted to proper type. (complex arithmetic expressions, unrecognized constants, etc.)remember to set datatypeupdates to ASE interface. Now supports experimental Octopus feature LatticeVectors, will not crash with spinors, input file parser can evaluate simple mathematical expressions (like 5 * angstrom) and uses a namespace to manage assignmentsbe more robust to unknown keywords
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