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Diffusion

· From Fick's first law: Jx = - D0 exp(-Q/kT) (dc/dx)
· Writing the concentration gradient in terms of Ni and the lattice spacing, a, gives: (dc/dx) = - (NC- NΑ)/a(a x 1 x 1)
· Substituting into the atomic expression for the net interstitial flux gives:
Jx = α(NΑ - NC) ν exp(- ΔGm /kT) = αa2ν exp (- ΔGm /kT)(dc/dx)
· Comparison with Fick's law yields: D0 = α a2ν and Q = ΔGm
· For the vacancy mechanism: Jx = α(NΑ - NC) ν exp(-[ ΔGm + ΔGV]/kT)
and the interpretation of D0 and Q changes.
· Comparing the expression for the net flux with Fick's first law gives:
Q = [ ΔGm + ΔGV] and D0 = ανa2
· The geometric parameter, α, must be determined before these quantities can be evaluated.