Develop #63
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Develop #63
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…issues if user manually enforces `numpy>1.24`
…ent anions / cations
…bours to apply bond distortions to
…n user specifies atom indexes
… energy basins (compared to Unperturbed) and renames them to High_Energy (to avoid rerunning them for more than 150 ionic steps)
Merge changes from `sync_dimer` branch
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Pulling to main now to fix issue with
snb-generatewhen defect name not specified (which happened to one user)