InorganicVII

Chapters / Chapter 1 · Solid state / Topic 10 of 14

Ionic crystals of AB2 type

Chapter 1 · Solid state and crystal structures

Fluorite, CaF2, 8:4

Ca2+ ions are arranged at the corners and at the centres of the faces of a cubic unit cell, and F− ions are at the centres of the eight small cubes into which the cell may be divided. Each Ca2+ is coordinated by 8 F− neighbours at the corners of a cube, while each F− has 4 Ca2+ neighbours.

This is the only structure in the notes with 8:4 coordination. The reverse structure, antifluorite, is taken by oxides such as Li2O and Na2O, with the cation and anion positions exchanged.

Rutile, TiO2, 6:3

The cation is octahedrally surrounded by six anions, while the anion (O2−) is trigonally surrounded by three cations. Rutile has a low-symmetry anion sublattice that fits neither a simple cubic nor an fcc lattice. The cation sublattice is a distorted body-centred cube, because one side of the cube differs from the others, the cation sublattice is actually body-centred tetragonal. The unit cell is tetragonal.