Chemical WorkBench

Chemistry simulation software

Chemical WorkBench is a proprietary simulation software tool aimed at the reactor scale kinetic modeling of homogeneous gas-phase and heterogeneous processes and kinetic mechanism development. It can be effectively used for the modeling, optimization, and design of a wide range of industrially and environmentally important chemistry-loaded processes. Chemical WorkBench is a modeling environment based on advanced scientific approaches, complementary databases, and accurate solution methods. Chemical WorkBench is developed and distributed by Kintech Lab.

## Chemical WorkBench models

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Chemical WorkBench has an extensive library of physicochemical models:

* Thermodynamic Models
* Gas-Phase Kinetic Models
* Flame model
* Heterogeneous Kinetic Models
* Non-Equilibrium Plasma Models
* Detonation and Aerodynamic Models
* Membrane Separation Models
* Mechanism Analysis and Reduction

## Fields of application

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Chemical WorkBench can be used by researchers and engineers working in the following fields:

* General chemical kinetics and thermodynamics
* Kinetic mechanisms development
* Thin films growth for microelectronics
* Nanotechnology
* Catalysis and chemical engineering
* Combustion, detonation and pollution control
* Waste treatment and recovering
* Plasma light sources and plasma chemistry
* High-temperature chemistry
* Education
* Combustion and detonation, clean power-generation technologies, safety analysis, CVD, heterogeneous and catalytic reactions and processes, and processes in non-equilibrium plasmas are the main areas of interest.

## External links

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* Chemical WorkBench web page
* Video Review of Chemical Workbench-Tool for Modeling Reactive Flows and Developing Chemical Mechanisms

## See also

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* Chemical kinetics
* Autochem
* Cantera
* CHEMKIN
* Kinetic PreProcessor (KPP)
* Laboratory information management system

## References

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1\. https://web.archive.org/web/20090108090305/http://www.softscout.com/software/Science-and-Laboratory/Scientific-Modeling-and-Simulation/Chemical-Workbench.html
2\. Deminsky, M; Chorkov, V; Belov, G; Cheshigin, I; Knizhnik, A; Shulakova, E; Shulakov, M; Iskandarova, I; Alexandrov, V; Petrusev, A; Kirillov, I; Strelkova, M; Umanski, S; Potapkin, B; et al. (2003). "Chemical Workbench––integrated environment for materials science". Computational Materials Science. 28 (2): 169–178\. doi:10.1016/S0927-0256(03)00105-8.

3\. Astapenko, M; Bagatur’yants, Alexander; Chernishova, Irina; Deminsky, Maxim; Eletskii, Alexander; Kirillov, Igor; Knizhnik, Andrei; Potapkin, Boris; Rykova, Elena; Umanskii, Stanislaw; Zaitsevskii, Andrei; Strelkova, Marina; Sukhanov, Leonid; Safonov, Andrei; Cotzas, George M.; Dean, Anthony; Michael, J. Darryl; Midha, Vikas; Smith, David J.; Sommerer, Timothy J.; Varatharajan, Bala; Tentner, Adrian; et al. (2007). "First-Principles-Based Development of Kinetic Mechanisms in Chemically Active Light-Emitting Nonthermal Plasmas and Gases". AIP Conf. Proc. 901: 204–2014\. doi:10.1063/1.2727370.

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