Normal Lattice: M+ and X- ions occupy regular positions
Schottky Defect: Equal numbers of M+ and X- ions migrate to crystal surface
Result: Paired cation-anion vacancies in the bulk crystal
Where:
VM- = Cation vacancy (negative effective charge)
VX+ = Anion vacancy (positive effective charge)
Where:
n = Number of Schottky defects per unit volume
N = Total number of ion pairs per unit volume
Es = Schottky defect formation energy
k = Boltzmann constant (8.617 × 10-5 eV/K)
T = Absolute temperature (K)
1. Similar Ionic Sizes: Cation and anion radii are approximately equal (r+ ≈ r-)
2. High Coordination Number: Usually observed in crystals with coordination number ≥ 6
3. Low Lattice Energy: Easier removal of ions from lattice positions
4. High Temperature: Increased thermal energy facilitates defect formation
5. Ionic Character: Predominantly ionic bonding rather than covalent
• NaCl (Halite): rNa⁺ = 1.02 Å, rCl⁻ = 1.81 Å
• KCl (Sylvite): rK⁺ = 1.38 Å, rCl⁻ = 1.81 Å
• KBr: rK⁺ = 1.38 Å, rBr⁻ = 1.96 Å
• CsCl: rCs⁺ = 1.70 Å, rCl⁻ = 1.81 Å
• CaF2: Fluorite structure with paired vacancies
• AgBr: Important in photographic processes
1. Density Decrease: Missing ions reduce overall crystal mass
2. Electrical Conductivity: Enhanced ionic conduction through vacancy mechanism
3. Diffusion Rates: Increased ion mobility via vacancy hopping
4. Dielectric Properties: Modified polarization behavior
5. Mechanical Properties: Reduced hardness and elastic moduli
Schottky Defects:
• Both cations and anions missing from lattice
• Ions migrate to crystal surface
• Density decreases
• Coordination number unchanged
• r+ ≈ r- (similar sizes)
Frenkel Defects:
• Only one type of ion (usually cation) displaced
• Ions move to interstitial positions
• Density remains constant
• Coordination environment distorted
• r+ << r- (small cation)