Structure 4001948

4001947 << 4001948 >> 4001949
Original COD entry Download CIF Download DOT

Citation: Kuo, Shu-Ming; Chang, Yu-Ming; Chung, In; Jang, Joon-Ik; Her, Bo-Hsian; Yang, Siao-Han; Ketterson, John B.; Kanatzidis, Mercouri G.; Hsu, Kuei-Fang (2013). New Metal Chalcogenides Ba4CuGa5Q12(Q = S, Se) Displaying Strong Infrared Nonlinear Optical Response. Chemistry of Materials, 25, pp. 2427-.

Formula: Ba Cu0.25 Ga1.25 S2.32 Se0.68

Cell parameters:

  • a = 13.1585(2) Å
  • b = 13.1585(2) Å
  • c = 6.3520(2) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: Cu4 Ga10 S24 Se24 (Cu2 Ga5 S12 Se12)

Multiplicity: 1

span 1 {1 1 1}