- 2024.10.31 -- Added a first tutorial
- Added a first tutorial to the documentation.
- 2024.10.30 -- Enhancements for energy/gradient drivers
- Added the standard properties for energy and gradient drivers so that aims can be used with the ThermoChemistry, Structure, and Reaction plug-ins.
- Changed defaults to make normal runs easier to set up.
- 2024.7.30 -- Fixed issue with initialization of fhi-aims.ini
- Fixed issue with the initialization of the fhi-aims.ini file if it did not exist.
- Cleaned up the section for seamm.ini now that it no longer handles the executable.
- 2024.1.19 -- Enhancements, but still debugging symmetry
- Added ability to write out the input file and not run FHI-aims
- Check if the calculation has been run, and don't rerun FHI-aims
- Switched to new method of executing background jobs that supports containers.
- 2023.9.8 -- Initial version
- Plug-in created using the SEAMM plug-in cookiecutter.