FAIRmat-NFDI / nomad-parser-plugins-simulation / 31017602547

Builds Branch Commit Type Ran Committer Via Coverage
31017602547 fix/wannier90-wien2k-numeric-sites Remove unrelated parser changes Pull #209 EBB2675 github
76.77
31017353011 fix/wannier90-wien2k-numeric-sites Fix Wannier90 structure parsing for WIEN2k numeric sites push EBB2675 github
76.81
31017209568 merge-vasp-lobster-doscar-parser Consolidate doscar parser Pull #208 ladinesa github
76.82
30922399797 develop Add scf annotation (#181) * Add SCF convergence criteria mapping for FHI-aims Add SelfConsistency annotation using multi-mapper pattern to extract convergence criteria (energy, density, eigenvalues) as separate instances alongside KSpace in DFT.... push web-flow github
76.73
30920622462 feature/fhiaims-scf-convergence-alvin Remove duplicate code Pull #181 ladinesa github
76.73
30904241676 minimal-orca-parser total_multiplicity to total_spin_multiplicity for clarity push EBB2675 github
77.64
30848983327 feature/fhiaims-scf-convergence-alvin Address review comments Pull #181 ladinesa github
76.73
30845974906 remove-manual-parsing-quantumespresso Remove special handling of electronic dos and bs Pull #207 ladinesa github
77.25
30820213295 minimal-orca-parser reflect schema changes total_spin to total_multiplicity push EBB2675 github
77.64
30818045397 rm-test-ams-scf-json rm file push EBB2675 github
76.74
30811391946 test-oasis Fix rebase push ladinesa github
76.42
30809921220 optimize-fhiaims Use line parsing for fhiaims out parser push Alvin Noe Ladines github
76.69
30807241402 develop Update phonopy to v3 (#203) push web-flow github
76.74
30805687380 update-phonopy Update phonopy to v3 push Alvin Noe Ladines github
76.74
30635095854 develop Parse the VASP DFT exchange-correlation functional and Jacob's ladder (#196) push GitHub github
76.76