Changelog

Most important changes in each released version.

v0.3.11

• Add options to manually set point defect concetration and number.

v0.3.10

• Add option to manually set crystal structure parameters (lattice constant and crytal type).

v0.3.9

• Add Dislocation identification and Grain identification.

v0.3.8

• Add tests for atomid package.

v0.3.7

• Add documentation and set up mkdocs.

v0.3.6

• Add polyhedral template matching for structure analysis.

v0.3.5

• Remove atomid.py file. Functionality is now in atomid.annotate module.

v0.3.4

• Added a feature to use KDTree for point defect detection. This feature is faster than the previous brute force implementation.

v0.3.3

• Added a feature to use approximate nearest neighbors search for point defect detection.