nomad-coe / nomad-simulations / 14353706672

Builds Branch Commit Type Ran Committer Via Coverage
14353706672 refactoring-model-system Merge remote-tracking branch 'origin/develop' into refactoring-model-system Pull #170 EBB2675 github
34.61
14352741464 develop removed all index references (#177) Co-authored-by: jrudz <rudzinski@mpip-mainz.mpg.de> push web-flow github
70.31
14352717752 update-pip-installation-without-index removed all index references Pull #177 jrudz github
70.31
14352680666 develop update test_atoms_state.py for l=0 (#178) push web-flow github
70.31
14352507837 update-pip-installation-without-index removed all index references Pull #177 jrudz github
70.31
14352485869 orbitals-allow-l0 update test_atoms_state.py for l=0 push EBB2675 github
70.31
14352211217 develop Remove validations (#167) * Outputs sub class * Remove setting of value shape * - Solve failing pipeline: apply `ElectronicStructureOutputs` where needed * Apply ruff * Remove checks for `shape`, as they are already satisfied by `Quantity` up... push web-flow github
70.31
14351993838 redo-physical-property relo uv constraint Pull #167 jrudz github
70.31
14342830168 redo-physical-property-JFR ruff Pull #175 jrudz github
70.31
14342779600 redo-physical-property-JFR reverted from ElectronicStructureOutputs to Outputs in tests Pull #175 jrudz github
70.31
14337411686 redo-physical-property-JFR reverted electronicoutputs push jrudz github
0.0
14335133487 refactoring-model-system add a note in GeometricSpace.get_geometric_space_for_atomic_cell Pull #170 EBB2675 github
38.78
14334151503 refactoring-model-system n_particles and particle_indices (instead of n_atoms and atom_indices) Pull #170 EBB2675 github
38.78
14332942081 refactoring-model-system remove redundant positions length checks Pull #170 EBB2675 github
38.78
14328882261 refactoring-model-system vector value for both collinear and noncollinear spin Pull #170 EBB2675 github
38.69