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. 2020 Jul 31;59(16):11704–11714. doi: 10.1021/acs.inorgchem.0c01593

Table 2. Interchain Correlations in Different Periodic Structural Models Defined by the Metal–Metal Relationships within the Metal Layers in (Cu1/3Ag1/3Au1/3)CN for Cu, Ag, and Au Atomsa.

    nearest-metal neighbors (r ∼ 3.4 Å)
next-nearest-metal neighbors (r ∼ 5.8 Å)
next-next-nearest-metal neighbors (r ∼ 6.8 Å)
structural model space group hetero- homo- hetero- homo- hetero- homo-
K P6mm{1}b 0 6 Cu···Cu 0 6 Cu···Cu 0 6 Cu···Cu
      6 Ag···Ag   6 Ag···Ag   6 Ag···Ag
      6 Au···Au   6 Au···Au   6 Au···Au
L R3m{3} 6 Cu···Ag 0 0 6 Cu···Cu 6 Cu···Ag 0
    6 Cu···Au     6 Ag···Ag 6 Cu···Au  
    6 Ag···Au     6 Au···Au 6 Ag···Au  
M Pmm2{2}, Cu–Au layers and Ag-only layers 8 Cu···Au 6 Ag···Ag 8 Cu···Au 6 Ag···Ag 0 6 Cu···Cu
      2 Cu···Cu   2 Cu···Cu   6 Ag···Ag
      2 Au···Au   2 Au···Au   6 Au···Au
N Pmm2{2}, Ag–Au layers and Cu-only layers 8 Ag···Au 6 Cu···Cu 8 Ag···Au 6 Cu···Cu 0 6 Cu···Cu
      2 Ag···Ag   2 Ag···Ag   6 Ag···Ag
      2 Au···Au   2 Au···Au   6 Au···Au
a

See section S.6 for details of models.

b

{n} denotes the number of (Cu1/3Ag1/3Au1/3)CN units in the unit cell.