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Crystal Lab › AB structures

Zinc blende (sphalerite) ZnS

AB, 4:4 (ccp) · space group F-43m (No. 216) · Z = 4

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Unit cell

Lattice constants
a = 5.410 Å, b = 5.410 Å, c = 5.410 Å; α = 90°, β = 90°, γ = 90°
Cell volume
158.3 ų
Atoms in the cell
8 (Zn 4, S 4)
Formula units Z
4
Calculated density
4.09 g cm⁻³
Shortest contact
2.343 Å

Coordination

Zn
CN 4 at 2.34 Å (4 S)
S
CN 4 at 2.34 Å (4 Zn)

About the structure

  • ccp array of S²⁻ with Zn²⁺ in half of the tetrahedral holes (4 of 8 per cell).
  • Coordination 4:4; the diamond framework with alternating atoms.
  • GaAs, InP, CdTe, CuCl and the III–V semiconductors share this structure.

Atom positions (fractional, one cell)

Atomxyz
Zn0.00000.00000.0000
Zn0.00000.50000.5000
Zn0.50000.00000.5000
Zn0.50000.50000.0000
S0.25000.25000.2500
S0.25000.75000.7500
S0.75000.25000.7500
S0.75000.75000.2500

Z, coordination numbers, distances, density and packing on this page are computed from these coordinates.

Other ab structures

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