Theory and Implementation DetailsΒΆ

A schematic overview of RMG is presented below.

A schematic overview of RMG

Many of the details of RMG’s original implementation (Version 1) are described in [JingThesis]. For a more recent discussion of RMG, see [GreenChapter].

Details of certain aspects of RMG are discussed in greater detail below.

[JingThesis]Jing Song. PhD thesis, Building Robust Chemical Reaction Mechanisms: Next Generation Automatic Model Construction Software. (MIT, 2004)
[GreenChapter]W. H. Green, “Predictive Kinetics: A New Approach for the 21st Century” Advances in Chemical Engineering, vol. 32.

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