R Functions for Solving Stoichiometric Equations

Given a list of substance compositions, a list of substances involved in a process, and a list of constraints in addition to mass conservation of elementary constituents, the package contains functions to build the substance composition matrix, to analyze the uniqueness of process stoichiometry, and to calculate stoichiometric coefficients if process stoichiometry is unique. (See Reichert, P. and Schuwirth, N., A generic framework for deriving process stoichiometry in enviromental models, Environmental Modelling and Software 25, 1241-1251, 2010 for more details.)


Reference manual

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install.packages("stoichcalc")

1.1-5 by Peter Reichert, 3 years ago


Browse source code at https://github.com/cran/stoichcalc


Authors: Peter Reichert


Documentation:   PDF Manual  


GPL (>= 2) license



Depended on by ecosim.


See at CRAN