Issues
- 7
AttributeError: 'Gratoms' object has no attribute '_cell' (with the latest version of ase.3.22.0 and catakit.0.5.4)
#95 opened by xilingyi - 0
Docstrings for all functions, classes
#66 opened by mhangaard - 0
- 0
Recommendations about merge
#104 opened by scott-5 - 0
Query for Delaunay triangulation
#103 opened by Asif-Iqbal-Bhatti - 1
Adsorbate splits in example script
#98 opened by LarsSchaaf - 0
ReactionNerwork(Catgen) error
#99 opened by KS-spec - 0
reporting alerts when import catkit
#97 opened by scott-5 - 1
Reporting 'Gratoms' object has no attribute '_cell' when instantiate surface object
#93 opened by yilinyang1 - 0
CatGen documentation example code doesn't work
#94 opened by ssyrnyk - 1
Gratoms attribute with _ missing? (_cell, _pbc)
#92 opened by addadyy - 1
- 7
get_voronoi_neighbors exhausts memory
#84 opened by mhangaard - 1
Improve molecule geometry prediction
#82 opened by ehermes - 2
- 3
Support of connectivity update when repeating slabs with periodic boundary conditions.
#65 opened by mhangaard - 1
Setup.py broken
#21 opened by mhoffman - 4