Commit 944d4f1d authored by Hagen-Henrik Kowalski's avatar Hagen-Henrik Kowalski
Browse files

Added

program_name
program_version
configuration_periodic_dimensions
single_configuration_calculation_to_system_ref
single_configuration_to_calculation_method_ref

And free energy is now given per atom not per cell
parent ea9a8d16
Pipeline #9280 passed with stage
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