v2.0.0
What's Changed
- Update code formatting by @yakutovicha in #161
- Remove pylint config by @yakutovicha in #165
- Modernise python package management by @yakutovicha in #166
- Adding test for cp2k_output and cp2k_output_advanced parsers by @AndresOrtegaGuerrero in #167
- Automate release with bumpver by @yakutovicha in #169
- Migrate to AiiDA 2.x by @yakutovicha in #172
- BaseRestartWorkChain:
remove resubmit_unconverged_geometry
handler. by @yakutovicha in #176 - Update badges. by @yakutovicha in #177
- Adding new exit code(501), Max optimization steps reached by @AndresOrtegaGuerrero in #178
- Adding a extra condition to restart_incomplete_calcution by @AndresOrtegaGuerrero in #179
- Update tests to new aiida's fixtures. by @yakutovicha in #181
New Contributors
- @AndresOrtegaGuerrero made their first contribution in #167
Full Changelog: v1.5.0...v2.0.0