Skip to content

Issues: tilde-lab/aiida-crystal-dft

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

16 Open 40 Closed
16 Open 40 Closed
Author
Filter by author
Loading
Label
Filter by label
Loading
Use alt + click/return to exclude labels
or ⇧ + click/return for logical OR
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

Failing *recursive_update* due to the details in the template bug Something isn't working
#66 opened Dec 18, 2022 by blokhin
2
Non-informative errors if yascheduler fails bug Something isn't working enhancement New feature or request help wanted Extra attention is needed
#63 opened Aug 21, 2022 by blokhin
@ansobolev
5
Additional workflow step to check a non-magnetic state energy enhancement New feature or request
#62 opened Aug 16, 2022 by blokhin
@blokhin
3
Cosmetic improvement of the exponential notation enhancement New feature or request
#58 opened Apr 8, 2021 by blokhin
2
AiiDA apparently confuses *p*- and *sp*-orbitals in our basis set implementation bug Something isn't working enhancement New feature or request
#57 opened Mar 28, 2021 by blokhin
@ansobolev
guess_spinlock: NotImplementedError: Structure does not contain transition elements bug Something isn't working enhancement New feature or request
#56 opened Mar 28, 2021 by blokhin
@ansobolev
1
Verdi daemon workers may consume all the RAM easily
#55 opened Mar 28, 2021 by blokhin
MPDS-AiiDA workflow has internal check inconsistency bug Something isn't working enhancement New feature or request
#54 opened Mar 28, 2021 by blokhin
@ansobolev
Phonon template problem bug Something isn't working
#53 opened Feb 22, 2021 by blokhin
@ansobolev
3
Add *get_geometry* from MPDS workflows to the *outline* enhancement New feature or request
#52 opened Feb 12, 2021 by blokhin
@ansobolev
1
D12 schema section fock_mixing should be merged with numerical enhancement New feature or request
#49 opened Dec 12, 2020 by blokhin
@ansobolev
Spelling: optimise should be optimize everywhere enhancement New feature or request
#48 opened Dec 9, 2020 by blokhin
Fort.25 parser bands problem
#47 opened Sep 24, 2020 by blokhin
@blokhin
1
SPECIAL_K still misses some cases
#46 opened Sep 23, 2020 by blokhin
3
Gaussian basis set handling is distributed (and re-implemented) across 3 different spots enhancement New feature or request
#34 opened Mar 26, 2020 by blokhin
Cannot cancel calculation
#4 opened May 22, 2019 by blokhin
1
ProTip! What’s not been updated in a month: updated:<2024-06-07.