• Home
  • Features
  • Pricing
  • Docs
  • Announcements
  • Sign In

stfc / janus-core / 9225311189
92%

Build:
DEFAULT BRANCH: main
Ran 24 May 2024 02:13PM UTC
Jobs 4
Files 21
Run time 1min
Badge
Embed ▾
README BADGES
x

If you need to use a raster PNG badge, change the '.svg' to '.png' in the link

Markdown

Textile

RDoc

HTML

Rst

24 May 2024 02:09PM UTC coverage: 93.377% (+0.4%) from 92.956%
9225311189

push

github

web-flow
Add phonons (#143)

* Add phonopy dependency

* Add seekpath for qpoints calculation

* Update .gitignore to ignore pdf and yaml files

* Allow ax as variable name

* Add initial phonons

* Allow list of supercell dimensions

* Remove plotting for phonons

* Add kwargs for phonons optimizer

* Tidy phonons

* Add initial phonons CLI

* Fix docs

* Update docstrings

* Add options for phonon CLI

* Add file prefix option for phonons

* Separate thermal property calculation from phonons

* Add default supercell value for phonons

* Add structure name option for phonon CLI

* Fix setting structure name for phonons

* Enable setting DOS and PSDOS file prefixes

* Add initial tests for phonon CLI

* Add logging for optimize via phonons

* Add tests for phonons

* Add logging for phonons

* Rename phonon params file

* Update README for phonons

* Add phonon CLI flags to summary

* Create separate functions to write phonon results

* Change hdf5 force constants to option

* Fix default mesh for phonons

* Refactor setting default filenames for phonons

* Add hdf5 to gitignore

* Tidy printing thermal properties for phonons

* Change phonon supercell input to string

* Add tests for supercell

* Update tests/test_phonons_cli.py

Co-authored-by: Jacob Wilkins <46597752+oerc0122@users.noreply.github.com>

* Tidy supercell CLI parsing

* Update janus_core/cli/phonons.py

* Update janus_core/calculations/phonons.py

* Update janus_core/cli/phonons.py

* restructure a little bit and test the permissions

* Update janus_core/cli/phonons.py

Co-authored-by: Jacob Wilkins <46597752+oerc0122@users.noreply.github.com>

* restructure a little bit and test the permissions

---------

Co-authored-by: ElliottKasoar <ElliottKasoar@users.noreply.github.com>
Co-authored-by: Jacob Wilkins <46597752+oerc0122@users.noreply.github.com>
Co-authored-by: Alin Marin Elena <alin@elena.re>

191 of 200 new or added lines in 3 files covered. (95.5%)

1128 of 1208 relevant lines covered (93.38%)

3.73 hits per line

New Missed Lines in Diff

Lines Coverage ∆ File
1
97.96
janus_core/cli/phonons.py
8
94.63
janus_core/calculations/phonons.py
Jobs
ID Job ID Ran Files Coverage
1 run-3.11 - 9225311189.1 24 May 2024 02:13PM UTC 21
93.21
GitHub Action Run
2 run-3.9 - 9225311189.2 24 May 2024 02:13PM UTC 21
93.38
GitHub Action Run
3 run-3.12 - 9225311189.3 24 May 2024 02:13PM UTC 21
93.21
GitHub Action Run
4 run-3.10 - 9225311189.4 24 May 2024 02:13PM UTC 21
93.21
GitHub Action Run
Source Files on build 9225311189
  • Tree
  • List 21
  • Changed 1
  • Source Changed 1
  • Coverage Changed 1
Coverage ∆ File Lines Relevant Covered Missed Hits/Line
  • Back to Repo
  • Github Actions Build #9225311189
  • 3e2adb82 on github
  • Prev Build on main (#9175393031)
  • Next Build on main (#9251170780)
STATUS · Troubleshooting · Open an Issue · Sales · Support · CAREERS · ENTERPRISE · START FREE · SCHEDULE DEMO
ANNOUNCEMENTS · TWITTER · TOS & SLA · Supported CI Services · What's a CI service? · Automated Testing

© 2026 Coveralls, Inc