Skip to content

Issues: pyscal/atomRDF

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

Clear current search query, filters, and sorts
13 Open 19 Closed
13 Open 19 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

Predicate should be hasChemicalSymbol instead of hasSymbol
#109 by NinadBhat was closed May 15, 2024
2
process_structure method does not work
#24 by srmnitc was closed Jun 21, 2023
query results could be a pandas dataframe
#39 by srmnitc was closed Jul 17, 2023
Autoquery needs fixing
#45 by srmnitc was closed Nov 28, 2023
1
Error when installing with conda
#64 by aazocar was closed Apr 3, 2024
2
Problem with query_sample function
#65 by aazocar was closed Apr 3, 2024
1
1
hasNumberOfAtoms field showing wrong numbers bug Something isn't working
#72 by NinadBhat was closed Apr 5, 2024
1
2
LatticeAngle for HCP angle should be 90, 90, 120 bug Something isn't working
#80 by NinadBhat was closed Apr 19, 2024
1
Volume calculation error bug Something isn't working
#81 by NinadBhat was closed Apr 16, 2024
2
species is a necessary input in StructureGraph
#23 by srmnitc was closed Jul 11, 2024
System returned from get_system_from_sample does not have a graph variable in it
#89 by NinadBhat was closed Apr 19, 2024
1
structure creation
#135 by sepidbgh was closed Jul 11, 2024
1
Missing the connection between structure_2 created from structured_1
#136 by sepidbgh was closed Jul 16, 2024
1
No delete function in KG
#137 by sepidbgh was closed Jul 18, 2024
1
Support aimsgb
#142 by aazocar was closed Jul 17, 2024
1
1
Tracking modifications
#156 by aazocar was closed Aug 6, 2024
1
Repeated structures do not have defect-related triples
#158 by GuojingHuangAa was closed Aug 15, 2024
1
3
add nglview visualisation
#160 by srmnitc was closed Aug 15, 2024
1
cannot create annotated GB from pyiron
#161 by srmnitc was closed Aug 15, 2024
1
ProTip! Follow long discussions with comments:>50.