stfc / janus

collection of scripts to train and generate data for machine learnt interatomic potentials
BSD 3-Clause "New" or "Revised" License
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Add RDF plotting #55

Closed ElliottKasoar closed 1 year ago

ElliottKasoar commented 1 year ago

Resolves #52

Based on plotting in https://github.com/MarsalekGroup/aml/blob/main/aml/score/util.py

To do: Further customisation e.g. specify ranges?