New features - Workflow for simplifying a dataset - Init reaction - More flexible cp2k input - Support Ali clould machines - Support non-periodic systems
Bug fixings - Full record of job information.
0.6.0
New features: - support aws - support electron temperature, as frame or atom parameter - data or iteration statatistics by run/report - build init surface via ase
Bug fixings: - job_id log in pmap does not work in lazy-local model - init_bulk cannot use batch system other than slurm