stfc / janus-core / 9383800737

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name ML properties in the results file by architecture, energy become… (#176)

* name ML properties in the results file by architecture, energy becomes mace_energy,...

* Update janus_core/calculations/single_point.py

Co-authored-by: Jacob Wilkins <46597752+oerc0122@users.noreply.github.com>

* Update janus_core/calculations/single_point.py

Co-authored-by: Jacob Wilkins <46597752+oerc0122@users.noreply.github.com>

* Update janus_core/calculations/single_point.py

Co-authored-by: Jacob Wilkins <46597752+oerc0122@users.noreply.github.com>

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Co-authored-by: Jacob Wilkins <46597752+oerc0122@users.noreply.github.com>

27 of 29 new or added lines in 1 file covered. (93.1%)

1282 of 1370 relevant lines covered (93.58%)

3.74 hits per line