nomad-FAIR merge requestshttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests2022-10-13T05:51:55Zhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/878Reference related issues.2022-10-13T05:51:55ZMarkus ScheidgenReference related issues.Fixes:
#985
#986
#1053
#1104Fixes:
#985
#986
#1053
#1104Markus ScheidgenMarkus Scheidgenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/869Resolve "Inherited subsections might break archive browser"2022-10-10T15:27:21ZMarkus ScheidgenResolve "Inherited subsections might break archive browser"Closes #1108Closes #1108https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/868Draft: Resolve "Inherited subsections might break archive browser"2022-10-06T08:22:14ZMarkus ScheidgenDraft: Resolve "Inherited subsections might break archive browser"Closes #1108Closes #1108https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/867Draft: Ikz eln into develop2023-12-21T08:50:16ZSebastian BruecknerDraft: Ikz eln into developUpdate ikz_eln to 1.1.5Update ikz_eln to 1.1.5Sebastian BruecknerSebastian Bruecknerhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/866Nexus eln examples2022-12-21T14:50:27ZSherjeel ShabihNexus eln examplesSherjeel ShabihSherjeel Shabihhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/863Resolve "Import error due to update in importlib-metadata"2022-10-03T11:51:13ZLauri HimanenResolve "Import error due to update in importlib-metadata"Closes #1107Closes #1107Lauri HimanenLauri Himanenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/862Resolve "Small search UI fixes"2022-09-30T12:02:09ZLauri HimanenResolve "Small search UI fixes"Closes #1101Closes #1101Lauri HimanenLauri Himanenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/860Modified the production gui config to use a relative url for the API and NORT...2022-09-30T11:25:01ZLauri HimanenModified the production gui config to use a relative url for the API and NORTH addresses.Closes #1096Closes #1096Lauri HimanenLauri Himanenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/857Small fixes2022-09-30T11:23:58ZMarkus ScheidgenSmall fixesMarkus ScheidgenMarkus Scheidgenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/856Resolve "Extended topology tests"2022-11-21T12:46:32ZThea DenellResolve "Extended topology tests"Closes #1077Closes #1077Thea DenellThea Denellhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/855Draft: Resolve "Extended topology tests"2022-09-28T07:19:08ZThea DenellDraft: Resolve "Extended topology tests"Closes #1077Closes #1077Thea DenellThea Denellhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/854Draft: Resolve "Extended topology tests"2022-09-28T07:16:32ZThea DenellDraft: Resolve "Extended topology tests"Closes #1077Closes #1077Thea DenellThea Denellhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/850Small fixes2022-09-26T08:33:22ZMarkus ScheidgenSmall fixesMarkus ScheidgenMarkus Scheidgenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/843Git flow docs2022-09-21T11:27:05ZMarkus ScheidgenGit flow docsMarkus ScheidgenMarkus Scheidgenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/834Resolve "hotfix: blocked pipelline"2022-09-19T09:41:50ZAdam FeketeResolve "hotfix: blocked pipelline"Closes #1065Closes #1065Adam FeketeAdam Feketehttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/833Fixes replacement of .nxdl at the end of the definition file2022-09-16T14:42:32ZFlorian DobenerFixes replacement of .nxdl at the end of the definition fileChange logic of ordering the replacement of cations in formulas to start with the shortest abbreviations firstChange logic of ordering the replacement of cations in formulas to start with the shortest abbreviations firstFlorian DobenerFlorian Dobenerhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/831Archive browser full storage quantities2022-09-16T10:51:46ZMarkus ScheidgenArchive browser full storage quantitiesMarkus ScheidgenMarkus Scheidgenhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/828Draft: Bring in latest Nexus features and corresponding ELNs2022-12-21T14:50:26ZSherjeel ShabihDraft: Bring in latest Nexus features and corresponding ELNsThis still does not have the IV_temp example. But I have tested it to work in a new nomad install.
TODOs:
- [ ] MPES container doesn't launch
- [x] Add IV temp example
- [x] Resolve dependency issues
- [ ] Make sure nexusparser function...This still does not have the IV_temp example. But I have tested it to work in a new nomad install.
TODOs:
- [ ] MPES container doesn't launch
- [x] Add IV temp example
- [x] Resolve dependency issues
- [ ] Make sure nexusparser functionality works on commit deployment
- [ ] Review by @kuehbachm
- [x] Review by @dflor
- [ ] Review by @ecaro
- [x] Update submodule for nomad-remote-tools
- [x] Update submodule for nomad-parser-nexus
- [x] Make issue for MetainfoError: Cannot serialize float64 quantitySherjeel ShabihSherjeel Shabihhttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/821Draft: Base section for crystal structure file parsing into the metainfo2023-02-15T10:02:00ZJose Marquez PrietoDraft: Base section for crystal structure file parsing into the metainfoA nomad User asked about how he could deposit crystal structure files from a structure generative ML model into nomad. Whilst the general discussion about how we are going to design a workflow for ML-generated data is gonna take some tim...A nomad User asked about how he could deposit crystal structure files from a structure generative ML model into nomad. Whilst the general discussion about how we are going to design a workflow for ML-generated data is gonna take some time, I have created a base class to parse structure files into the nomad metainfo. At the moment, it writes the `run.system` section, but I understand from the discussion in #1038 that the section run is reserved for DFT codes. Should it be ok to put a System section in `data` and the parse this to Results?
@mscheidg @himanel1, any advice on how would you approach this?
Thanks!Jose Marquez PrietoJose Marquez Prietohttps://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR/-/merge_requests/817Update order of normalizing functions for JV curve2022-09-15T06:38:54ZJose Marquez PrietoUpdate order of normalizing functions for JV curveUpdate in the normalizing functions of two solar cell base classes, in which the ordering of running them was conflicting.Update in the normalizing functions of two solar cell base classes, in which the ordering of running them was conflicting.Jose Marquez PrietoJose Marquez Prieto