A computer program for the calculation of equilibrium concentrations in complex systems

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Bos, M. and Meershoek, H.Q.J. (1972) A computer program for the calculation of equilibrium concentrations in complex systems. Analytica Chimica Acta, 611 (2). pp. 185-199. ISSN 0003-2670

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Abstract:A general computer program has been developed for the calculation of equilibrium concentrations in complex systems. The use of the reaction extents as master variables in the equilibrium constant equations yields a considerable saving in computer time in comparison to existing programs. The setting up of the equations for the calculations from the chemical equilibria can be automated.
Item Type:Article
Copyright:© 1972 Elsevier Science
Link to this item:http://purl.utwente.nl/publications/68049
Official URL:http://dx.doi.org/10.1016/S0003-2670(01)95051-2
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