Structure 4003499

4003498 << 4003499 >> 4003500
Original COD entry Download CIF Download DOT

Citation: Li, Zhuang; Zhang, Shengzi; Huang, Zhiwei; Zhao, Li-Dong; Uykur, Ece; Xing, Wenhao; Lin, Zheshuai; Yao, Jiyong; Wu, Yicheng (2020). Molecular Construction from AgGaS2 to CuZnPS4: Defect-Induced Second Harmonic Generation Enhancement and Cosubstitution-Driven Band Gap Enlargement. Chemistry of Materials, , pp. -.

Formula: Cu P S4 Zn

Cell parameters:

  • a = 5.4980(4) Å
  • b = 5.4980(4) Å
  • c = 9.2110(10) Å
  • α = 90°
  • β = 90°
  • γ = 90°

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 P2 S8 Zn4 (Cu2 P S4 Zn2)

Multiplicity: 1

span 1 {1 1 1}