22672006931
0%

Ran 04 Mar 2026 01:45PM UTC

Jobs 1

Files 28

Run time 1min

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Committed 04 Mar 2026 01:43PM UTC coverage: 0.22% (-0.02%) from 0.238%

Build # 22672006931

Build Type

push

github

Committed by

web-flow

Commit Message

Vibrational analysis workflow (#12)

* Switch optimisation workflow to use new aiida-chemshell optimisation workflow with vibrational analysis

* Create node view widget for visualising vibrational frequency table

* Create improved viewer for final energy with associated units

* Improve qm_region input field

Run Details

2 of 910 relevant lines covered (0.22%)

0.0 hits per line

Uncovered Existing Lines

Lines	∆	File
2	0.0%	opt/hostedtoolcache/Python/3.12.12/x64/lib/python3.12/site-packages/aiidalab_chemshell/models/workflow.py
25	0.0%	opt/hostedtoolcache/Python/3.12.12/x64/lib/python3.12/site-packages/aiidalab_chemshell/wizards/workflows/geometry_optimisation.py
32	0.0%	opt/hostedtoolcache/Python/3.12.12/x64/lib/python3.12/site-packages/aiidalab_chemshell/wizards/workflows/main_view.py
46	0.0%	opt/hostedtoolcache/Python/3.12.12/x64/lib/python3.12/site-packages/aiidalab_chemshell/common/node_viewers.py
49	0.0%	opt/hostedtoolcache/Python/3.12.12/x64/lib/python3.12/site-packages/aiidalab_chemshell/process.py

Jobs

ID	Job ID	Ran	Files	Coverage
1	22672006931.1	04 Mar 2026 01:45PM UTC	28	0.22	GitHub Action Run

stfc / aiidalab-chemshell / 22672006931
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