GitHub / ExeQuantCode/ARTEMIS issues and pull requests
#38 - Improve documentation
Issue -
State: open - Opened by nedtaylor 10 months ago
Labels: documentation
#37 - [PROPOSAL] Unit tests
Issue -
State: open - Opened by nedtaylor 10 months ago
Labels: enhancement
#36 - Python library
Pull Request -
State: open - Opened by nedtaylor 10 months ago
Labels: bug, documentation, enhancement, support
#35 - Library
Pull Request -
State: closed - Opened by nedtaylor 10 months ago
Labels: documentation, enhancement
#34 - Input file overwriting
Issue -
State: open - Opened by nedtaylor over 1 year ago
#34 - [PROPOSAL] Print interface fit number in `DXXX/struc_dat.txt`
Issue -
State: closed - Opened by nedtaylor about 1 year ago
- 1 comment
Labels: enhancement
#33 - Incorrect termination step number
Issue -
State: open - Opened by nedtaylor over 1 year ago
Labels: bug, has attachment
#33 - [PROPOSAL] Stoichiometry input tags
Issue -
State: closed - Opened by nedtaylor about 1 year ago
- 1 comment
Labels: enhancement
#32 - Change licence
Pull Request -
State: open - Opened by nedtaylor over 1 year ago
Labels: discussion
#32 - Fix natom check
Pull Request -
State: closed - Opened by nedtaylor about 1 year ago
- 2 comments
Labels: bug
#31 - Slab orthogonaliser routine breaking ISHIFT = 4
Issue -
State: open - Opened by nedtaylor over 1 year ago
Labels: bug
#31 - [BUG] Incorrect catching of wrong number of atoms in slab
Issue -
State: closed - Opened by nedtaylor about 1 year ago
Labels: bug
#30 - Resolve "Incorrect termination step number"
Pull Request -
State: open - Opened by nedtaylor about 1 year ago
Labels: bug
#30 - BULK BOND being searched for when not using ISHIFT = 4
Issue -
State: open - Opened by nedtaylor over 3 years ago
#29 - Development
Pull Request -
State: closed - Opened by nedtaylor about 1 year ago
- 3 comments
#29 - Not finding rectangular fit from public release
Issue -
State: open - Opened by nedtaylor over 3 years ago
Labels: has attachment
#28 - Termination identification failure
Issue -
State: closed - Opened by nedtaylor over 3 years ago
- 3 comments
Labels: has attachment
#28 - Development
Pull Request -
State: closed - Opened by nedtaylor about 1 year ago
- 3 comments
#27 - generate_interfaces test directory incorrect
Issue -
State: open - Opened by nedtaylor almost 4 years ago
Labels: has attachment
#27 - Draft: Development
Pull Request -
State: closed - Opened by nedtaylor about 1 year ago
- 1 comment
#26 - Development
Pull Request -
State: closed - Opened by nedtaylor about 1 year ago
- 8 comments
#26 - Check if primitive primitive and Niggli reduced cell used
Issue -
State: open - Opened by nedtaylor almost 4 years ago
- 1 comment
#25 - ISHIFT=4 more neighbours in slab than bulk
Issue -
State: open - Opened by nedtaylor about 4 years ago
- 6 comments
Labels: has attachment
#25 - Lat match fix - [merged]
Issue -
State: closed - Opened by nedtaylor over 3 years ago
- 2 comments
Labels: gitlab merge request
#24 - Elastic compensate - [merged]
Issue -
State: closed - Opened by nedtaylor over 3 years ago
- 2 comments
Labels: gitlab merge request
#24 - SrZrO3 artemis cuts along wrong plane
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 3 comments
Labels: has attachment
#23 - Fortran if(present(VAR).and.VAR) not allowed
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 3 comments
#23 - Improved output printing - [merged]
Pull Request -
State: closed - Opened by nedtaylor almost 4 years ago
- 2 comments
Labels: gitlab merge request
#22 - CaZrO3 symmetry not recognised between two 001 CaO surfaces
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 7 comments
Labels: has attachment
#22 - Don issue - [merged]
Issue -
State: closed - Opened by nedtaylor almost 4 years ago
- 3 comments
Labels: gitlab merge request
#21 - test
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 1 comment
#21 - Improve error catching - [merged]
Issue -
State: closed - Opened by nedtaylor almost 4 years ago
- 3 comments
Labels: gitlab merge request
#20 - Mac compile issues - [merged]
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 5 comments
Labels: gitlab merge request
#20 - TiO2 symmetry ladder issue
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 3 comments
Labels: has attachment
#19 - not forming larger structures even when layers are increased in newinput
Issue -
State: open - Opened by nedtaylor over 4 years ago
- 13 comments
Labels: has attachment
#19 - SrZrO3 termination issues - [merged]
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 3 comments
Labels: gitlab merge request
#18 - Resolve "CaZrO3 symmetry not recognised between two 001 CaO surfaces" - [merged]
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 10 comments
Labels: gitlab merge request
#18 - NSHIFT issue
Issue -
State: closed - Opened by nedtaylor over 4 years ago
- 1 comment
#17 - Input file overwriting
Issue -
State: open - Opened by nedtaylor over 1 year ago
#17 - Input file overwriting
Issue -
State: open - Opened by nedtaylor over 1 year ago
#16 - Incorrect termination step number
Pull Request -
State: open - Opened by nedtaylor over 1 year ago
Labels: bug, has attachment
#16 - Incorrect termination step number
Issue -
State: open - Opened by nedtaylor over 1 year ago
Labels: bug, has attachment
#15 - Change licence
Issue -
State: open - Opened by nedtaylor over 1 year ago
Labels: discussion
#15 - Change licence
Issue -
State: open - Opened by nedtaylor over 1 year ago
Labels: discussion
#14 - Slab orthogonaliser routine breaking ISHIFT = 4
Issue -
State: open - Opened by nedtaylor over 1 year ago
Labels: bug
#14 - Slab orthogonaliser routine breaking ISHIFT = 4
Pull Request -
State: open - Opened by nedtaylor over 1 year ago
Labels: bug
#13 - BULK BOND being searched for when not using ISHIFT = 4
Issue -
State: open - Opened by nedtaylor over 3 years ago
#13 - BULK BOND being searched for when not using ISHIFT = 4
Issue -
State: open - Opened by nedtaylor over 3 years ago
#12 - Not finding rectangular fit from public release
Issue -
State: open - Opened by nedtaylor over 3 years ago
Labels: has attachment
#12 - Not finding rectangular fit from public release
Issue -
State: open - Opened by nedtaylor over 3 years ago
Labels: has attachment
#11 - Termination identification failure
Issue -
State: closed - Opened by nedtaylor over 3 years ago
- 3 comments
Labels: has attachment
#11 - Termination identification failure
Issue -
State: closed - Opened by nedtaylor over 3 years ago
- 3 comments
Labels: has attachment
#10 - generate_interfaces test directory incorrect
Issue -
State: open - Opened by nedtaylor almost 4 years ago
Labels: has attachment
#10 - generate_interfaces test directory incorrect
Issue -
State: open - Opened by nedtaylor almost 4 years ago
Labels: has attachment
#9 - Check if primitive primitive and Niggli reduced cell used
Issue -
State: open - Opened by nedtaylor almost 4 years ago
- 1 comment
#9 - Check if primitive primitive and Niggli reduced cell used
Issue -
State: open - Opened by nedtaylor almost 4 years ago
- 1 comment
#8 - ISHIFT=4 more neighbours in slab than bulk
Issue -
State: open - Opened by nedtaylor about 4 years ago
- 6 comments
Labels: has attachment
#8 - ISHIFT=4 more neighbours in slab than bulk
Issue -
State: open - Opened by nedtaylor about 4 years ago
- 6 comments
Labels: has attachment
#7 - SrZrO3 artemis cuts along wrong plane
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 3 comments
Labels: has attachment
#7 - SrZrO3 artemis cuts along wrong plane
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 3 comments
Labels: has attachment
#6 - Fortran if(present(VAR).and.VAR) not allowed
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 3 comments
#6 - Fortran if(present(VAR).and.VAR) not allowed
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 3 comments
#5 - CaZrO3 symmetry not recognised between two 001 CaO surfaces
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 7 comments
Labels: has attachment
#5 - CaZrO3 symmetry not recognised between two 001 CaO surfaces
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 5 comments
Labels: has attachment
#3 - TiO2 symmetry ladder issue
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 3 comments
Labels: has attachment
#3 - TiO2 symmetry ladder issue
Issue -
State: closed - Opened by nedtaylor about 4 years ago
- 3 comments
Labels: has attachment
#2 - not forming larger structures even when layers are increased in newinput
Issue -
State: open - Opened by nedtaylor over 4 years ago
- 7 comments
Labels: has attachment
#2 - not forming larger structures even when layers are increased in newinput
Issue -
State: open - Opened by nedtaylor over 4 years ago
- 7 comments
Labels: has attachment
#1 - NSHIFT issue
Pull Request -
State: closed - Opened by nedtaylor over 4 years ago
- 1 comment
#1 - NSHIFT issue
Issue -
State: closed - Opened by nedtaylor over 4 years ago
- 1 comment