aiida-raspa v1.2.0

• Base RaspaBaseWorkChain on BaseRestartWorkChain from aiida-core. (#56)

Release v1.1.0

Drop Python2 support.

Release 1.0.0

This is the official aiida-raspa 1.0.0 Release.

• The plugin is fully compatible with AiiDA>=1.0.0.
• Considerably re-designed plugin (7d72685).
• Automated testing infrastructure.
• RaspaBaseWorkChain implementation (fb355cf).
• Modifications to compute binding energy (#46)
• Add read the docs (#47)

Release v1.0.0a1

prepare release v1.0.0a1

Release 0.3.0

• significantly improved output file parser
• better block pockets handling
• all examples now use click library
• updated readme
• added initial version of the RaspaConvergeWorkChain

Fix parsing of the absolute & excess loading

This release is due to the bug found in parsing of the absolute and excess loading. Before the excess loading was parsed and stored as the absolute loading

... in addition it contains small enhancements of the example scripts