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Chemical Reaction Engineering Module

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Hydrocarbon Dehalogenation in a Tortuous MicroreactorHydrocarbon Dehalogenation in a Tortuous Microreactor

Removing halogen groups from hydrocarbons is an important reaction step in several chemical processes. One application is water purification. Other examples involve organic synthesis, where the removal of halogen groups serves as a...

Hydrodealkylation in a Membrane ReactorHydrodealkylation in a Membrane Reactor

This model demonstrates how you can access and include external thermodynamic and physical property calculations in your simulation, using the Thermodynamics feature. The model shows how you can easily modify the predefined Plug-flow...

Isoelectric SeparationIsoelectric Separation

This modeling example applies the Transport of Diluted Species interface to model a separation process. A stream containing six different ionic species is divided into pure component streams by means of migrative transport in an electric...

A 3D Model of a Diesel Particulate FilterA 3D Model of a Diesel Particulate Filter

Several factors influence a diesel particulate filter’s (DPF) efficiency and durability. Important issues include the removal of soot particles from the filter membranes and the influence of thermal stress on the ceramic structure,...

Estimating Thermal Dispersion in a Packed BedEstimating Thermal Dispersion in a Packed Bed

Thermal dispersion in a porous medium results from the combined effects of heat conduction in the fluid and solid phases, and from convective transport in the fluid. In chemical process engineering, the modeling of thermal dispersion is...

Boat Reactor for Low Pressure Chemical Vapor DepositionBoat Reactor for Low Pressure Chemical Vapor Deposition

Chemical vapor deposition (CVD) is an important step in the process of manufacturing microchips. One of the common applications is the deposition of silicon on wafers at low pressure. Low pressure reactors are used to get a high...

Catalytic Converter for an ExhaustCatalytic Converter for an Exhaust

This model describes a common piece of equipment from the chemical and automotive industries: the catalytic converter for exhaust streams. It investigates coupling free and porous media with chemical reaction kinetics. The model...

Fully-coupled Physics with Joule Heating, CFD and Chemical ReactionsFully-coupled Physics with Joule Heating, CFD and Chemical Reactions

In this example, a fluid carrying several chemical components is pumped into a detector compartment. A wire in the center of the detector is heated through Joule heating, which is supposed to detect changes in density through convective...

Maxwell-Stefan Diffusion in a Fuel Cell Unit CellMaxwell-Stefan Diffusion in a Fuel Cell Unit Cell

In concentrated gases and liquids, where the concentrations of species are of the same order of magnitude, there is no obvious solvent-solute relationship. Fick’s law for diffusion accounts only for one-way solute-solvent interactions...

Nonisothermal Plug Flow ReactorNonisothermal Plug Flow Reactor

This model considers the thermal cracking of acetone, which is a key step in the production of acetic anhydride. The gas phase reaction takes place under nonisothermal conditions in a plug-flow reactor. As the cracking chemistry is...