nomad-FAIR merge requestshttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests2021-08-06T06:57:09Zhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/363Fixed orjson and uvicorn dependencies.2021-08-06T06:57:09ZLauri HimanenFixed orjson and uvicorn dependencies.Lauri HimanenLauri Himanenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/1673Fixed outdated gui test artifacts.2024-02-15T15:05:59ZMarkus ScheidgenFixed outdated gui test artifacts.https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/432Fixed parser metadata generation2021-10-25T11:22:26ZMarkus ScheidgenFixed parser metadata generationhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/1575Fixed performance problem when deciding visibility for entries.2023-12-01T14:05:28ZMarkus ScheidgenFixed performance problem when deciding visibility for entries.https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/80Fixed prototype detection2020-01-27T07:47:18ZLauri HimanenFixed prototype detectionThis merge request fixes issue #258.
I have made a corrected copy of structure_types.py from nomadcore and included it in normalizing/data. This way we don't break the nomadcore package if it still relies on the old prototype info. Th...This merge request fixes issue #258.
I have made a corrected copy of structure_types.py from nomadcore and included it in normalizing/data. This way we don't break the nomadcore package if it still relies on the old prototype info. This will also make it easier to completely ditch nomadcore in the future.
I included a function in structure.py for updating the prototype information. This will have to be rerun e.g. if our symmetry detection routine changes. I included a quick check that will raise an Exception if trying to use the data after changing the symmetry tolerance.
I included a test that checks that at least the very basis prototypes (diamond, fcc, bcc, wurtzite, rocksalt, zincblende) are correctly matched.Markus ScheidgenMarkus Scheidgenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/1309Fixed ref to electronicparsers submodule2023-05-24T08:37:32ZJose PizarroFixed ref to electronicparsers submodulehttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/936> Fixed regex fermi_level in FHIaims2022-11-10T12:33:21ZJose Pizarro> Fixed regex fermi_level in FHIaimsCloses #939Closes #939https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/331Fixed reprocess mainfile matching for published uploads.2021-05-03T11:31:31ZMarkus ScheidgenFixed reprocess mainfile matching for published uploads.https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/333Fixed reprocess with matching and VASP calculations.2021-05-03T13:45:40ZMarkus ScheidgenFixed reprocess with matching and VASP calculations.https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/327Fixed reversed single point convergence2021-04-28T17:12:34ZAlvin Noe LadinesFixed reversed single point convergenceMarkus ScheidgenMarkus Scheidgenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/218Fixed several viewer issues2020-12-09T14:29:21ZLauri HimanenFixed several viewer issuesFixed problem with metainfo section names (e.g. `section_system` vs `System`) causing the viewers to not appear, fixed issue with automatic sizing of BrillouinZoneViewer, added support for k-point paths with missing segment labels.Fixed problem with metainfo section names (e.g. `section_system` vs `System`) causing the viewers to not appear, fixed issue with automatic sizing of BrillouinZoneViewer, added support for k-point paths with missing segment labels.Markus ScheidgenMarkus Scheidgenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/1064Fixed small issues with the developers setup of nomad2023-01-31T08:07:04ZMarkus ScheidgenFixed small issues with the developers setup of nomadChangelog: FixedChangelog: Fixedhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/1394Fixed soap problems.2023-07-09T08:33:10ZMarkus ScheidgenFixed soap problems.https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/265Fixed some issues in the developer setup process.2021-02-25T14:53:13ZMarkus ScheidgenFixed some issues in the developer setup process.https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/1437fixed storage of times in archive_to_universe, and recoded Rg value calc and...2023-08-11T15:56:57ZJoseph Rudzinskifixed storage of times in archive_to_universe, and recoded Rg value calc and...fixed storage of times in archive_to_universe, and recoded Rg value calc and storage in workflow normalizer
Closes #1643fixed storage of times in archive_to_universe, and recoded Rg value calc and storage in workflow normalizer
Closes #1643Joseph RudzinskiJoseph Rudzinskihttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/1134Fixed the availability of the beta/test snack in the UI.2023-03-06T15:24:00ZMarkus ScheidgenFixed the availability of the beta/test snack in the UI.The UI should show a snack that informs users, if there
are not using the official NOMAD, but a test or beta installation.
This snack was not shown due to a problem in the new config
model.
Changelog: Fixed.The UI should show a snack that informs users, if there
are not using the official NOMAD, but a test or beta installation.
This snack was not shown due to a problem in the new config
model.
Changelog: Fixed.https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/1131Fixed the backend test batch to actually show the coverage.2023-03-05T12:03:05ZMarkus ScheidgenFixed the backend test batch to actually show the coverage.Changelog: FixedChangelog: Fixedhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/1736Fixed the keycloak image registry used by docker-compose example.2024-03-15T15:08:31ZMarkus ScheidgenFixed the keycloak image registry used by docker-compose example.The official keycloak images seem to be hosted on a different
registry now.
Changelog: FixedThe official keycloak images seem to be hosted on a different
registry now.
Changelog: Fixedhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/1326Fixed the name of the fhi parser.2023-05-31T07:17:42ZMarkus ScheidgenFixed the name of the fhi parser.The name was accidentally changed, presumably when adding the
plugins. It is now changed back. It is important that the
name does not change, because of existing entries.
Changelog: FixedThe name was accidentally changed, presumably when adding the
plugins. It is now changed back. It is important that the
name does not change, because of existing entries.
Changelog: Fixedhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/1057Fixed the README batches and changed pipeline to push tags to github.2023-01-25T12:35:16ZMarkus ScheidgenFixed the README batches and changed pipeline to push tags to github.Changelog: FixedChangelog: Fixed