orgdisord.merge.merge_rematch

orgdisord.merge.merge_rematch(supercell_images, eps=0.001, quiet=False, parallel=True)

This merging algorithm creates a fingerprint for each structure bases on the SOAP representation and then used the ReMatch kernel to try to find equivalences.

It contains a number of parameters that would need to be fine tuned In my testing, it works pretty well for small systems, but it overzealous at merging larger systems…

More work is necessary!