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Please use this identifier to cite or link to this collection:
DOI: 10.19061/iochem-bd-6-699
This dataset derived results are published in:
Manuscript title: TASTET: a Python package for geometry-driven selection of representative atomistic structures from large configurational spaces
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- ROOT
- Cu_nanoclusters
- fps_selected
- Rh_conformers
- round1_fps
- round2_global_fps
- round2_local_neighborhood
- round2_region_selection
- uff_selection25
- Cu_nanoclusters
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