Skip to content

Issues: stfc/janus-core

New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

Sign up for GitHub

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

41 Open 159 Closed
41 Open 159 Closed
Author
Filter by author
Loading
Label
Filter by label
Loading
Use alt + click/return to exclude labels
or ⇧ + click/return for logical OR
Projects
Filter by project
Loading
Milestones
Filter by milestone
Loading
Assignee
Filter by who’s assigned
Sort
Sort by
Newest Oldest Most commented Least commented Recently updated Least recently updated Best match
Most reactions
👍 👎 😄 🎉 😕 ❤️ 🚀 👀

Issues list

specify temperature and current temperature in atoms.info bug Something isn't working
#433 opened Feb 19, 2025 by alinelena
tutorial material
#432 opened Feb 19, 2025 by alinelena
14 tasks
MD stats files appends by default bug Something isn't working
#431 opened Feb 18, 2025 by ElliottKasoar
add mattersim enhancement New/improved feature or request
#425 opened Feb 14, 2025 by alinelena
1
@alinelena
Add example config files documentation Improvements or additions to documentation
#423 opened Feb 13, 2025 by ElliottKasoar
@ElliottKasoar
Add NEB tutorial documentation Improvements or additions to documentation
#422 opened Feb 13, 2025 by ElliottKasoar
@ElliottKasoar
add support for fairchem enhancement New/improved feature or request
#420 opened Feb 13, 2025 by alinelena
1
@alinelena
2
Documentation "fails" on release bug Something isn't working documentation Improvements or additions to documentation
#419 opened Feb 12, 2025 by ElliottKasoar
Missing NPT-MTK tutorial documentation Improvements or additions to documentation
#418 opened Feb 12, 2025 by k-harris27
nvt-csvr ensemble doesn't support temperature ramp bug Something isn't working
#413 opened Feb 10, 2025 by k-harris27
1
Merge struct and struct_path parameters? enhancement New/improved feature or request question Further information is requested
#412 opened Feb 10, 2025 by ElliottKasoar
1
expose etol for geometry optimisation enhancement New/improved feature or request
#409 opened Feb 7, 2025 by alinelena
1
add support for grace enhancement New/improved feature or request
#408 opened Feb 6, 2025 by alinelena
1
@alinelena
Use progress bar for MD enhancement New/improved feature or request good first issue Good for newcomers
#405 opened Feb 4, 2025 by ElliottKasoar
1
Use progress bar for descriptors enhancement New/improved feature or request good first issue Good for newcomers
#404 opened Feb 4, 2025 by ElliottKasoar
Add user installation/upgrade instructions documentation Improvements or additions to documentation
#397 opened Jan 31, 2025 by ElliottKasoar
@ElliottKasoar
1
Add Nudge Elastic Band enhancement New/improved feature or request
#375 opened Jan 3, 2025 by ElliottKasoar Requirements for paper release
1
@ElliottKasoar
Improve defaults enhancement New/improved feature or request
#370 opened Dec 12, 2024 by ElliottKasoar
@ElliottKasoar
Use slice.indices() enhancement New/improved feature or request
#364 opened Dec 4, 2024 by oerc0122
add support for fairchem enhancement New/improved feature or request
#363 opened Dec 3, 2024 by alinelena Requirements for paper release
@alinelena
Add upload option enhancement New/improved feature or request
#359 opened Nov 28, 2024 by ElliottKasoar Requirements for paper release
@ElliottKasoar
2
phonon bands compressed make it option enhancement New/improved feature or request good first issue Good for newcomers
#356 opened Nov 22, 2024 by alinelena Requirements for paper release
Consider context manager for CLI summary enhancement New/improved feature or request
#345 opened Nov 4, 2024 by ElliottKasoar
Update torch/dgl enhancement New/improved feature or request
#328 opened Oct 9, 2024 by ElliottKasoar
4
Use progress bar for additional calculations enhancement New/improved feature or request good first issue Good for newcomers
#324 opened Oct 8, 2024 by ElliottKasoar
3
ProTip! Updated in the last three days: updated:>2025-02-16.