nomad-coe / nomad-simulations / 19034093744

Builds Branch Commit Type Ran Committer Via Coverage
19034093744 sprint-dft-qchem fix mypy in model_system.py Pull #237 EBB2675 github
90.95
19033785399 sprint-dft-qchem fix mypy Pull #237 EBB2675 github
90.95
18972879821 sprint-dft-qchem revise determinant and its spin coupling form Pull #237 EBB2675 github
90.93
18972727541 sprint-dft-qchem remove SOC from the scope of this PR Pull #237 EBB2675 github
90.93
18972669931 sprint-dft-qchem remove CoreElectronTreatment from the scope of this PR Pull #237 EBB2675 github
90.94
18972588740 sprint-dft-qchem add range parameter specification, remove obsolete quantities Pull #237 EBB2675 github
90.66
18972291677 sprint-dft-qchem fix unused variable Pull #237 EBB2675 github
90.66
18967845542 sprint-dft-qchem remove self_interaction_method Pull #237 EBB2675 github
90.66
18904802674 auto-generate-docs fixed jinja template formatting Pull #267 JFRudzinski github
90.27
18901324601 auto-generate-docs minimal auto schema docs generation Pull #267 JFRudzinski github
90.27
18831691221 sprint-dft-qchem remove default value for weight Pull #237 EBB2675 github
90.66
18774115931 sprint-dft-qchem add a field for core state relativity Pull #237 EBB2675 github
90.66
18773733066 sprint-dft-qchem fix LibXC utilities being dependent on the schema Pull #237 EBB2675 github
90.83
18594497000 warnings_and_errors merge develop Pull #260 kubanmar github
90.26
18496245040 sprint-dft-qchem add range_separation_function to XCComponent Pull #237 EBB2675 github
90.83