What is Diffusion coefficient?

The coefficient D expressing how readily atoms diffuse, in units of m²/s. It depends on temperature in the Arrhenius form D = D₀exp(−Q/RT).

Japanese name: 拡散係数

Diffusion coefficient appears in 6 practice questions across 1 topic, including Crystal defects and diffusion.

Field: Crystal defects and diffusion

What the diffusion coefficient means

The diffusion coefficient D is the proportionality constant in Fick's first law, J = −D(dC/dx), that links the concentration gradient to the flow of atoms (the flux). Its unit is m²/s (cm²/s is also common), and the larger it is, the faster atoms spread. A rough distance over which atoms spread in time t is √(Dt). For example, with D = 10⁻¹¹ m²/s, atoms spread about 0.2 mm in one hour (3600 s). It is the basic quantity for estimating carburized case depths, dopant diffusion depths and the growth of reaction layers in solder joints.

Temperature dependence and the Arrhenius plot

The diffusion coefficient depends exponentially on temperature, D = D₀exp(−Q/RT). Q is the activation energy needed for an atom to jump to a neighboring site, and D₀ is a constant that includes the vibration frequency and jump distance. Plotting ln D against 1/T (an Arrhenius plot) gives a straight line, and Q is obtained from its slope −Q/R. The larger Q, the stronger the effect of temperature, and a difference of a few tens of degrees can change the diffusion rate several times over. In calculations, it is essential to convert temperatures to absolute temperature.

The mechanism changes the order of magnitude

Small atoms such as carbon, nitrogen and hydrogen in iron move by interstitial diffusion, jumping between interstitial sites, so their diffusion coefficients are large. Substitutional atoms diffuse by the vacancy mechanism, moving only when a vacancy arrives next to them; the activation energy also includes the vacancy formation energy, so diffusion is far slower. In addition, diffusion along grain boundaries, surfaces and dislocations, where the atomic arrangement is disordered, has a lower activation energy and can dominate over lattice diffusion at low temperatures. This is why grain boundary diffusion stands out in polycrystalline thin films.

Interdiffusion and practical use

When different atoms diffuse into each other, as when two metals are bonded, the diffusion coefficient of each kind of atom (the intrinsic diffusion coefficient) must be distinguished from the interdiffusion coefficient that describes the overall change in concentration. The difference between them shows up as marker movement and void formation through the Kirkendall effect. In practice, the diffusion coefficient at the treatment temperature is calculated from literature values of D₀ and Q, and the concentration profile is predicted with the error-function solution. Values differ between data sources, so it is safer to compare several before use.

Try it: questions about Diffusion coefficient

Carbon diffuses at steady state through a 5.0 mm thick steel plate whose two faces are held at carbon concentrations of 1.2 kg/m³ and 0.8 kg/m³. If the diffusion coefficient is 3.0×10⁻¹¹ m²/s, which value is closest to the diffusion flux of carbon? Assume the concentration varies linearly through the thickness.

  1. AAbout 2.4×10⁻¹² kg/(m²·s)
  2. BAbout 7.2×10⁻⁹ kg/(m²·s)
  3. CAbout 2.4×10⁻⁹ kg/(m²·s)
Show answer and explanation

Answer: C. About 2.4×10⁻⁹ kg/(m²·s)

At steady state, Fick's first law J = −D(dC/dx) applies. The concentration gradient is (0.8 − 1.2)/(5.0×10⁻³ m) = −80 kg/m⁴, so J = 3.0×10⁻¹¹ × 80 = 2.4×10⁻⁹ kg/(m²·s), flowing from the high-concentration side to the low-concentration side. About 2.4×10⁻¹² is a unit-conversion error from dividing by the thickness left as 5.0 in mm, and about 7.2×10⁻⁹ uses the concentration on one side, 1.2 kg/m³, instead of the concentration difference. It is the concentration difference that drives the flow, so getting the gradient right matters. The same approach is used in hydrogen permeation tests and in evaluating gas separation membranes.

The diffusion coefficient of carbon in γ-iron follows the Arrhenius form D = D₀exp(−Q/RT) with D₀ = 2.3×10⁻⁵ m²/s and activation energy Q = 148 kJ/mol. Which value is closest to the diffusion coefficient at 927 °C? Take the gas constant as R = 8.314 J/(mol·K).

  1. AAbout 8.3×10⁻¹² m²/s
  2. BAbout 1.1×10⁻¹³ m²/s
  3. CAbout 2.3×10⁻⁵ m²/s
Show answer and explanation

Answer: A. About 8.3×10⁻¹² m²/s

Convert the temperature to absolute temperature: T = 927 + 273 = 1200 K. Q/RT = 148000/(8.314 × 1200) ≈ 14.83, so D = 2.3×10⁻⁵ × exp(−14.83) ≈ 2.3×10⁻⁵ × 3.6×10⁻⁷ ≈ 8.3×10⁻¹² m²/s. About 1.1×10⁻¹³ is the mistake of substituting the temperature as 927 in °C. About 2.3×10⁻⁵ is the mistake of leaving Q as 148 in kJ, which makes the exponent nearly zero and gives almost the same value as D₀. Because D changes exponentially with temperature, raising the carburizing temperature by just a few tens of degrees can shorten the treatment time considerably.

FAQ

Why is the unit of the diffusion coefficient m²/s?

In J = −D(dC/dx), the flux J has units of (amount)/(m²·s) and the concentration gradient (amount)/m⁴, so D has units of m²/s. This is also consistent with √(Dt) being a length.

How many degrees must the temperature be raised to double the diffusion coefficient?

It depends on the activation energy and the temperature. Solve ln 2 = (Q/R)(1/T₁ − 1/T₂); for example, with Q = 150 kJ/mol and T₁ = 1200 K, raising the temperature by about 58 K roughly doubles the diffusion coefficient.

How are the diffusion coefficient and the diffusion length related?

A rough diffusion distance in time t is √(Dt) (or 2√(Dt), depending on the definition). The distance is proportional to the square root of time, so doubling the depth takes four times as long.

Diffusion coefficient in the explanations

Questions that mention Diffusion coefficient (6)

  1. Carbon diffuses at steady state through a 5.0 mm thick steel plate whose two faces are held at carbon concentrations of 1.2 kg/m³ and 0.8 kg/m³. If the diffusion coefficient is 3.0×10⁻¹¹ m²/s, which value is closest to the diffusion flux of carbon? Assume the concentration varies linearly through the thickness.
  2. The diffusion coefficient of carbon in γ-iron follows the Arrhenius form D = D₀exp(−Q/RT) with D₀ = 2.3×10⁻⁵ m²/s and activation energy Q = 148 kJ/mol. Which value is closest to the diffusion coefficient at 927 °C? Take the gas constant as R = 8.314 J/(mol·K).
  3. The diffusion coefficient of an element was 1.0×10⁻¹⁴ m²/s at 800 K and 4.0×10⁻¹³ m²/s at 1000 K. Assuming the Arrhenius form D = D₀exp(−Q/RT), which value is closest to the activation energy Q? Take R = 8.314 J/(mol·K).
  4. A steel containing 0.20 wt% carbon is carburized with its surface carbon concentration held at 1.00 wt%. Which value is closest to the time needed for the carbon concentration to reach 0.60 wt% at a depth of 0.50 mm? Take the diffusion coefficient as 1.6×10⁻¹¹ m²/s, (C − C₀)/(Cₛ − C₀) = 1 − erf(x/2√(Dt)), erf(0.371) = 0.40 and erf(0.477) = 0.50.
  5. In α-iron at the same temperature, the diffusion coefficient of carbon is many orders of magnitude larger than that of nickel. Which is the main reason?
  6. Which statement about diffusion paths in a polycrystalline metal is correct?

Materials Science Calculators

Related terms

Carburizing Fick's laws Vacancy Burgers vector Dislocation

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