The Wolfram Solution for

Chemical Engineering

Simulate your chemical processes with ready-to-deploy, fully interactive models using a combination of powerful computation, statistics and optimization, instant interactivity, and built-in chemical data. One system, one integrated workflow.

Underlying the Wolfram chemical engineering solution is the world's most sophisticated differential equation solving with automatic algorithm selection, self-checking precision control, and symbolic preprocessing–everything to get accurate results efficiently.

Ready-to-use, built-in curated data on thousands of chemical compounds
The Wolfram Edge
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Key Capabilities

Mathematica and SystemModeler include thousands of built-in functions that let you:

  • Solve coupled nonlinear differential equations for chemical kinetic modeling and applications in transport phenomena
  • Design and optimize unit operations such as distillation and adsorption processes in a chemical plant
  • Develop thermodynamic models to predict vapor-liquid equilibria of non-ideal mixtures
  • Compute Laplace transformations for process control applications
  • Determine the numerical solution of transport equations, advanced heat and mass transfer problems, and other transport phenomena applications
  • Perform economic viability analysis for chemical plant design using built-in economic, financial, geographic, and demographic data

Finding an optimal control signal for a continuously stirred tank reactor (CSTR) with Wolfram SystemModeler

Interactively studying unsteady-state conduction of heat in two dimensions

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The Wolfram Edge
How Wolfram Compares
Key Capabilities

Does your current tool set have these advantages?

  • Instantly create dynamic interfaces that allow you to vary parameters and gain useful insights from data, a feature especially useful for reaction engineering/kinetics, process design, and transport phenomena
    Instant creation of interactive interfaces is not possible in other software
  • Built-in, powerful statistical analysis and optimization routines for analyzing large amounts of data from experiments
    Matlab requires extra-cost toolbox to perform statistical analysis
  • Sophisticated typesetting for chemical and mathematical equations, standard word processing, and interactive applications in a single document
    Not available in other software
  • Integrated automatic report generation to document tasks you perform in Mathematica and instantly generate reports with graphics, text, and code
    Matlab requires purchase of extra toolbox; Sage, Octave, and other freeware do not support automatic report generation
  • Automated precision control and arbitrary precision numerics produce highly accurate results
    Fortran, Excel, Matlab, and other systems relying on finite precision numerics can create serious errors due to lack of precision
  • Advanced string and pattern matching and sequence alignment capabilities for biochemical applications
    Matlab requires purchase of toolbox
  • Built-in parallel computing capabilities for solving computation- or data-intensive problems on multicore computers
    Matlab requires purchase of extra toolbox for parallel computing; all other major software systems require extensive programming to parallelize processes
  • Seamless integration of numerics, symbolics, interactive graphics, and all other computational aspects in one document
    Not possible in other software

Comparing physical and safety properties of chemical compounds for an experiment

Separation of chemicals: McCabe & Thiele graphical method

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The Wolfram Edge
How Wolfram Compares
Key Capabilities

Wolfram SystemModeler is the most complete physical modeling and simulation tool for high-fidelity modeling. Capabilities include:


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