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Please use this identifier to cite or link to this collection: DOI: 10.19061/iochem-bd-6-444

This dataset derived results are published in:

Manuscript title: Revisits the Selectivity toward C2+ Products for CO2 Electroreduction over Subnano-Copper Clusters Based on Structural Descriptors

Journal: ACS Catal.

DOI: 10.1021/acscatal.4c07759

View as
  • ROOT
    • C-O-H-Cu-cluster
      • 140-Wullf
        • CHOCHO
        • COCHO
        • COCO
        • corner
        • edge
        • facet1
        • facet2
      • 147-D5h
        • corner1
        • corner2
        • edge1
        • edge2
        • edge3
        • edge4
        • facet1
        • facet2
      • 147-Ih
        • CHOCHO
        • COCHO
        • COCO
        • corner
        • edge
        • facet
      • 147-Oh
        • corner
        • edge
        • facet1
        • facet2
      • 165-Wullf
        • corner
        • edge
        • facet1
        • facet2
      • 225-Wullf
        • corner
        • edge1
        • edge2
        • facet1
        • facet2
        • facet3
      • 309-D5h
        • corner1
        • corner2
        • edge1
        • edge2
        • facet1
        • facet2
      • 309-Ih
        • corner
        • edge1
        • edge2
        • facet
      • 309-Oh
        • corner1
        • edge1
        • facet1
        • facet2
      • 38-Wullf
        • CHOCHO
        • COCHO
        • COCO
        • corner
        • facet
      • 55-D5h
        • CHOCHO
        • COCHO
        • COCO
        • corner1
        • corner2
        • edge12
        • edge3
        • edge4
        • facet
      • 55-Ih
        • CHOCHO
        • COCHO
        • COCO
        • corner
        • edge
      • 79-Wullf
        • CHOCHO
        • COCHO
        • COCO
        • corner
        • edge
        • facet
      • 85-Wullf
        • corner
        • edge1
        • edge2
        • facet
    • bare-Cu-cluster
      • rpso
      • slab
      • symmetric_
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