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Generate container for solid state electronics Installing and Testing #325: Commit 9d3d505 pushed by ndaelman-hu
January 30, 2025 18:10 1m 0s remove_phys_prop
remove_phys_prop
January 30, 2025 18:10 1m 0s
Refactor def and normalizer Installing and Testing #324: Commit 0b39f46 pushed by ladinesa
January 29, 2025 22:36 1m 17s add-workflows
add-workflows
January 29, 2025 22:36 1m 17s
Set up test template generator Installing and Testing #323: Commit 4430a3b pushed by ndaelman-hu
January 29, 2025 16:34 1m 10s remove_phys_prop
remove_phys_prop
January 29, 2025 16:34 1m 10s
Add method and results Installing and Testing #322: Commit 9232147 pushed by ladinesa
January 28, 2025 16:20 50s add-workflows
add-workflows
January 28, 2025 16:20 50s
Add plotly visualization Installing and Testing #321: Commit 66f234b pushed by ndaelman-hu
January 28, 2025 15:13 53s remove_phys_prop
remove_phys_prop
January 28, 2025 15:13 53s
minor modifications Installing and Testing #320: Commit b0eb159 pushed by EBB2675
January 28, 2025 13:42 1m 14s qc-model-method-contributions
qc-model-method-contributions
January 28, 2025 13:42 1m 14s
Remove editable annotations (#162) Installing and Testing #319: Commit fe81d97 pushed by ndaelman-hu
January 28, 2025 10:32 1m 4s develop
develop
January 28, 2025 10:32 1m 4s
Linting fix Installing and Testing #318: Commit 4e35a66 pushed by ladinesa
January 28, 2025 09:50 1m 13s add-workflows
add-workflows
January 28, 2025 09:50 1m 13s
improved class descriptions, new MolecularOrbitals class, improved Ha… Installing and Testing #317: Commit 92fd95e pushed by EBB2675
January 28, 2025 09:29 1m 8s qc-model-method-contributions
qc-model-method-contributions
January 28, 2025 09:29 1m 8s
Initial workflow defs Installing and Testing #316: Commit 0530c27 pushed by ladinesa
January 28, 2025 09:04 1m 0s add-workflows
add-workflows
January 28, 2025 09:04 1m 0s
Generate foundational base section, i.e. ModelBaseSection Installing and Testing #315: Commit f62eb98 pushed by ndaelman-hu
January 24, 2025 18:47 2m 4s remove_phys_prop
remove_phys_prop
January 24, 2025 18:47 2m 4s
- Remove ELNAnnotation imports Installing and Testing #314: Commit ea40f74 pushed by ndaelman-hu
January 24, 2025 15:31 1m 14s clean_schema
clean_schema
January 24, 2025 15:31 1m 14s
Remove annotations Installing and Testing #313: Commit f885f1e pushed by ndaelman-hu
January 24, 2025 14:42 1m 19s clean_schema
clean_schema
January 24, 2025 14:42 1m 19s
Apply ruff Installing and Testing #312: Commit 0e773dd pushed by ndaelman-hu
January 24, 2025 13:21 1m 4s clean_schema
clean_schema
January 24, 2025 13:21 1m 4s
- Deactivate EditQuantity annotations Installing and Testing #311: Commit 55cc292 pushed by ndaelman-hu
January 24, 2025 13:16 1m 17s clean_schema
clean_schema
January 24, 2025 13:16 1m 17s
add a placeholder MolecularOrbitalsState Installing and Testing #310: Commit 6f3e30b pushed by EBB2675
January 15, 2025 12:54 59s qc-model-method-contributions
qc-model-method-contributions
January 15, 2025 12:54 59s
- Add PhysicalPropertyDecomposition to standardize contributions Installing and Testing #309: Commit 17cf3bb pushed by ndaelman-hu
January 14, 2025 20:33 58s test_new_physical_props
test_new_physical_props
January 14, 2025 20:33 58s
enhance LocalCorrelation and CoupledCluster Installing and Testing #308: Commit 95e319c pushed by EBB2675
January 14, 2025 10:24 1m 13s qc-model-method-contributions
qc-model-method-contributions
January 14, 2025 10:24 1m 13s
fix ROKS issue, minor modifications in model_method Installing and Testing #307: Commit d90eac1 pushed by EBB2675
January 13, 2025 08:27 1m 17s qc-model-method-contributions
qc-model-method-contributions
January 13, 2025 08:27 1m 17s
errors to warnings Installing and Testing #306: Commit b4df654 pushed by JFRudzinski
January 9, 2025 09:36 1m 2s cg-particle-support-JFR
cg-particle-support-JFR
January 9, 2025 09:36 1m 2s
more angle progress Installing and Testing #305: Commit 95352d3 pushed by JFRudzinski
January 9, 2025 08:55 1m 1s 113-add-force-field-schema
113-add-force-field-schema
January 9, 2025 08:55 1m 1s
modify reference determinants in HF base class Installing and Testing #304: Commit 271f69c pushed by EBB2675
January 2, 2025 09:53 1m 5s qc-model-method-contributions
qc-model-method-contributions
January 2, 2025 09:53 1m 5s
add MEnum for GTOIntegralDecomposition Installing and Testing #303: Commit 09b0dfc pushed by EBB2675
January 2, 2025 08:28 1m 18s qc-model-method-contributions
qc-model-method-contributions
January 2, 2025 08:28 1m 18s
- Move out electronic physical properties Installing and Testing #302: Commit 430bfb8 pushed by ndaelman-hu
December 18, 2024 18:21 1m 4s test_new_physical_props
test_new_physical_props
December 18, 2024 18:21 1m 4s
Extend to band structures Installing and Testing #301: Commit ba97b08 pushed by ndaelman-hu
December 18, 2024 12:40 58s test_new_physical_props
test_new_physical_props
December 18, 2024 12:40 58s