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QCMP069. MSIMPC:An Interactive Discrete
Chemical Mechanism Simulator
by W. D. Hinsberg and F. A. Houle, IBM Research Division, Almaden Research Center, 650 Harry Road, San Jose, California 95120 The program allows simulation of reactions carried out at constant temperature, variable temperature, or variable temperature and pressure. The input consists of a reaction mechanism in conventional chemical notation, rate constants, and run conditions such as initial concentrations and temperature. Concentration vs. time curves for all species are calculated and can be output in graphical and/or tabular form. Although primarily intended for chemical applications, the method can be applied to any process which can be described by a sequence of steps, each having a characteristic rate. Borland Turbo PASCAL (version 5.0) Microsoft QuickBasic Lines of Code: 5411 |