🧪 Binary Diffusivity Estimator

Estimate the binary diffusion coefficient DAB as a function of temperature, pressure, and species properties using Chapman–Enskog for gases and Wilke–Chang for liquids.

🌫️ Molecular Diffusion Schematic

📝 Configuration

⚙️ Model Selection
🧬 Species Selection
📌 Molecular Properties
💧 Liquid Solvent Inputs
Typical: water 2.26, methanol 1.9, ethanol 1.5, non-associated 1.0
Key Equations:

Gas, Chapman–Enskog:
DAB = 0.001858 T3/2 √(1/MA+1/MB) / [P σAB² ΩD] [cm²/s]

Liquid, Wilke–Chang:
DAB = 7.4×10−8 (φ MB)1/2 T / [μB VA0.6] [cm²/s]

📊 Results & Visualization

Configure inputs and click Calculate to view results.

ℹ️ About Binary Diffusivity

DAB quantifies how fast species A diffuses through species B. Gas diffusivity increases strongly with temperature and decreases with pressure. Liquid diffusivity is much smaller and depends strongly on solvent viscosity and solute molar volume.

📘 Calculation Methodology

Mathematical Model & Theory

The gas model uses Lennard-Jones collision parameters and a diffusion collision integral. The liquid model estimates infinite-dilution diffusivity of a dilute solute in a liquid solvent.

Worked Engineering Example

Oxygen in water at 25°C: using Wilke-Chang with μ = 0.890 cP, φ = 2.26, MB = 18.015 g/mol and VA = 25.6 cm³/mol gives DAB on the order of 2×10−9 m²/s.

Assumptions & References

  • Chapman-Enskog: dilute, non-polar gas pair, ideal-gas pressure dependence.
  • Wilke-Chang: dilute solute, empirical liquid diffusivity near ambient liquid conditions.
  • Use measured diffusivity data when high accuracy is required.