Change Log

Notable changes are logged here by release. This project is not expected to be especially active and follows a simplified Semantic Versioning:

Version numbers take the format X.Y
X is associated with major API breakage / changes in algorithm and results.
Y is associated with minor updates and improvements
Small amounts of code tidying, refactoring and documentation do not lead to a new release, and simply sit on the Development branch of the Git repository.

The changelog format is inspired by keep-a-changelog.

Unreleased

"sendto" now looks for a config file in home directory
"sendto" options to skip large VASP files
New CPLAP plotter
Add "get-minimum" for quick extraction of low-energy structure from trajectory

1.0 - 2016-04-25

Add "get-volume" for quick read of volume
Add "get-energy" for quick read of energy
Update all "get" tools for Python3 compatibility and simpler interface
- Input file is now consistently the first positional argument so no need to remember which optional flag is needed.

0.2 - 2016-11-04

Fix broken get-spacegroup interface
Add reader/converter for ATAT SQS files

0.1 - 2016-11-04

Begin proper organisation of repository and packaging
Tools collected from various projects
- Reasonably functional components
  - ase-convert
  - get-primitive
  - get-spacegroup
  - vectors
- Primitive / work-in-progress
  - get-vbm
  - vasp-charge
- Possibly too "personal"
  - sendto
Packaging with pip
GPL license