Skip to main content
SpringerLink
Log in

Computer aided exploitation of mathematical models of processes. A general description of the approach

  • Original Papers
  • Published:
Microchimica Acta Aims and scope Submit manuscript

Abstract

An approach is described which helps the experimenter in: (a) selecting the most appropriate method of determination of physicochemical or technical parameters, (b) optimization of analytical procedures or of determination of physicochemical parameters, (c) indication of the possible improvements of the experimental technique applied, (d) diagnosis of the model and the data handling scheme applied in the determination of parameters, and other. The examples presented are based on simulated experiments. They concern selection of the best method for determination of an equilibrium constant and for determination of two analytes from a single instrumental (photometric, potentiometric) titration curve.

This is a preview of subscription content, log in via an institution to check access.

Access this article

Log in via an institution

Price excludes VAT (USA)
Tax calculation will be finalised during checkout.

Instant access to the full article PDF.

Institutional subscriptions

Similar content being viewed by others

References

  1. A. Parczewski, G. Kateman,Prototype of an expert system for examination of solution equilibria and development of titration methods, presented during 5th International School on Expert Systems Technology, Rzeszow, 1989.

  2. A. Parczewski,Chemom. Intell. Lab. Systems 1990,8, 227.

    Google Scholar 

  3. T. Meites, L. Meites,Talanta 1972,19, 1131.

    Google Scholar 

  4. D. M. Barry, L. Meites, B. H. Campbell,Anal. Chim. Act 1974,69, 143.

    Google Scholar 

  5. G. Nowogrocki, J. Canonne, M. Wozniak,Bull. Soc. Chim. Fr. 1976,1–2, 5.

    Google Scholar 

  6. S. R. Goode,Anal. Chem. 1977,49, 1408.

    Google Scholar 

  7. G. Nowogrocki, J. Canonne, M. Wozniak,Anal. Chim. Acta 1979,112, 185.

    Google Scholar 

  8. E. R. Still,Talanta 1980,27, 573.

    Google Scholar 

  9. H. Gampp, M. Maeder, A. D. Zuberbuhler,Talanta 1980,27, 1037.

    Google Scholar 

  10. L. M. Schwartz,Anal. Chim. Acta 1980,122, 291.

    Google Scholar 

  11. M. Wozniak, G. Nowogrocki,Talanta 1981,28, 575.

    Google Scholar 

  12. A. D. Zuberbuhler, T. A. Kaden,Talanta 1982,29, 201.

    Google Scholar 

  13. J. C. Smit, H. C. Smit,Anal. Chim. Acta 1982,143, 45.

    Google Scholar 

  14. J. Polster,GIT Fachz. Lab. 1983,27, 390.

    Google Scholar 

  15. G. Kateman, H. C. Smit, L. Meites,Anal. Chim. Acta 1983,152, 61.

    Google Scholar 

  16. H. C. Smit, L. Meites, G. Kateman,Anal. Chim. Acta 1983,153, 121.

    Google Scholar 

  17. C. Rigano, M. Grasso, S. Sammartano,Ann. Chim. 1984,74, 537.

    Google Scholar 

  18. M. Meloun, J. Havel,Computation of Solution Equilibria, Folia Facultatis Scientiarum Naturalium Universitatis Purkynianae Brunensis, Chemia, Vol. X X V, Brno, 1984, andVol. X X V I, Brno, 1985.

  19. H. Gampp, M. Maeder, C. J. Meyer, A. D. Zuberbuhler,Talanta 1985,32, 95.

    Google Scholar 

  20. E. Leporati,Anal. Chim. Acta 1985,170, 287.

    Google Scholar 

  21. T. Michalowski, R. Stepak,Anal. Chim. Acta 1985,172, 207.

    Google Scholar 

  22. D. Ph. Zollinger,Computerized Methods for the Determination of Stability Constants.Complexation of Crown Ethers with Organic Molecules. Doctoral Thesis, Technische Hogeschool, Twente, 1986.

    Google Scholar 

  23. J. Kragten, P. C. de Jagher, L. G. Decnop-Weever,Anal. Chim. Acta 1986,180, 457.

    Google Scholar 

  24. M. Betti, P. Papoff, L. Meites,Anal. Chim. 1986,182, 133.

    Google Scholar 

  25. A. Hioki, N. Fudagawa, M. Kubota, A. Kawase,Talanta 1989,36, 1203.

    Google Scholar 

  26. J. J. Baeza Baeza, G. Ramis Ramos, C. Mongay Fernandez,Anal. Chim. Acta 1990,237, 473.

    Google Scholar 

  27. I. B. C. Matheson,Computers Chem. 1990,14, 49.

    Google Scholar 

  28. M. N. Moreno, J. L. Gonzales, M. Angeles del Arco, J. Casado,Computers Chem. 1990,14, 165.

    Google Scholar 

  29. A. Parczewski, G. Kateman (in preparation).

  30. A. Parczewski,Chem. Anal. (Warsaw) 1976,21, 59.

    Google Scholar 

  31. A. Parczewski,Talanta 1987,34, 586;1988,35, 473.

    Google Scholar 

Download references

Author information

Author notes

  1. A. Parczewski

    Present address: Faculty of Chemistry, Jagiellonian University, Ingardena 3, Krakow, Poland

Authors and Affiliations

  1. Department of Analytical Chemistry, University of Nijmegen, NL-6525 ED, Toernooiveld, Nijmegen

    A. Parczewski, J. Kragten & G. Kateman

  2. Laboratory for Analytical Chemistry, University of Amsterdam, Nieuwe Achtergracht 166, NL-1018, WV Amsterdam, The Netherlands

    J. Kragten

Authors
  1. A. Parczewski
    View author publications

    You can also search for this author in PubMed Google Scholar

  2. J. Kragten
    View author publications

    You can also search for this author in PubMed Google Scholar

  3. G. Kateman
    View author publications

    You can also search for this author in PubMed Google Scholar

Rights and permissions

Reprints and permissions

About this article

Cite this article

Parczewski, A., Kragten, J. & Kateman, G. Computer aided exploitation of mathematical models of processes. A general description of the approach. Mikrochim Acta 108, 173–184 (1992). https://doi.org/10.1007/BF01242427

Download citation

  • Received:

  • Revised:

  • Issue Date:

  • DOI: https://doi.org/10.1007/BF01242427

Key words

Search

Navigation