Computers in Chemical Education and Research - download pdf or read online

By Professor Martha E. Williams (auth.), Eduardo V. Ludeña, Nora H. Sabelli, Arnold C. Wahl (eds.)

ISBN-10: 1468424068

ISBN-13: 9781468424065

ISBN-10: 1468424084

ISBN-13: 9781468424089

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43 COMPUTER AIDED DESIGNS AND DATA PROCESSING v. olution (F~S) System The CRAlIS System ean solve any eombination of special forms of non-linear (or equilibrium) and first-order ordinary differential (or rate) equations. The key to its sueeessful implementation has been the generalized data-struetures. partieularly the FLuX-MATRIX. viewed as the logieal generalization of CRAMS System, that will solve any eombination of equations of whatever form. ßTRIX eoneept and devising new algorithms for its manipulation.

It has the same form as the INITIALIZE. data-set. 001 respectively. SIMULATOR, POSTPROCESSOR and SELECTOR are the names of the data-sets that control output from the SOLVER, POST-PROCESSOR and SELECTOR parts of CRAMS. Details will be found in [12]. STOP: Is used to indicate the end of a problem. PREPROCESSOR: This part uses standard mathematical methods to compute a common time scale for all reactants. It also uses the Newton-Rapson method t~ compute values for the derivatives and their associated maximum tolerances at every time point for each reactant.

E. changed relations) would have to be developed. REFERENCES 1. H. "Data Element Analysis and Use of a Relational Data Base Structure for Mapping Bibliographic and Numeric Data Bases" in MAPPING CHEMICAL DATA BASES Management of OSta Elements in Information Processing, Proceedings of a Second Symposium, National Bureau of Standards, 1975, p. 237-247. 2. F. "A Re1ationa1 Model of OSta for Large Shared OSta Banks" Communications of the Association for Computing Machinery, 13: 377-387, 1970. 3. F.

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Computers in Chemical Education and Research by Professor Martha E. Williams (auth.), Eduardo V. Ludeña, Nora H. Sabelli, Arnold C. Wahl (eds.)


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