Most important changes in each released version.
- Add options to manually set point defect concetration and number.
- Add option to manually set crystal structure parameters (lattice constant and crytal type).
- Add Dislocation identification and Grain identification.
- Add tests for atomid package.
- Add documentation and set up mkdocs.
- Add polyhedral template matching for structure analysis.
- Remove atomid.py file. Functionality is now in
atomid.annotatemodule.
- Added a feature to use KDTree for point defect detection. This feature is faster than the previous brute force implementation.
- Added a feature to use approximate nearest neighbors search for point defect detection.