Abstract
An algorithm based on variable Metric method has been applied to the determination of molecular thermodynamic model parameters from experimental data when any model need several constraints. Implementation of the method is illustrated in the reduction of multi-property equation of state data for the systems of argon, nitrogen and methane.
Similar content being viewed by others
References
Powell, M.J.D.: “Variable Metric Methods for constrained optimization,” presented at the third International Symposium on computing Methods in Applied Sciences and Engineering, IR1A, France. (1977).
Powell, M.J.D.: “A Fortran Subroutine for Constrained Optimization,” DAMTP; 82/NAA. (1982).
Yoo, K.P.: Ph.D Dissertation. University Connecticut (1984).
Rockafellar, R.J.: “Mathematical Programing,” vol. 5. pp. 354–373 (1973).
Han, S.P.: “Mathematical Programing,” vol 11, pp. 263–282 (1976).
Powell, M.J.D.: “A fast Algorithm for nonlinear constraints that use Lagrangian functions,” presented at the 9th International Symposium on Mathematical Programing, Budapest (1977).
Dennis, J.E. and More, J.:SIAM Review, 19, 46(1977).
Biggs, M.C.: “Constrained Minimization Using recursive Quatratic Programing”; in Towers Global optimization, eds. Dixon L.C.W. and Szego, G.P., North-Holland, Publishing Co., Amsterdam (1972).
Han, S.P.: A globally convergence method for nonlinear Programing. Report No. 75-257. Dept. of Computer Science, Cornell Univ. (1975).
Carnahan, N.F., and Starling, K.E.:AlChE, 1, 18, 1184(1972).
Vera, J.H. and Prausnitz, J.M.:Chem. Eng. 1, 3, (1972).
Anderson, T.F. and Prausnitz, J.M.: 1 & EC. Proc. Des. & Dev. 19, 1(1980).
Yoo, K.P. and Anderson T.F.:Ind. Eng. Chem. Fundam. 22., 177(1983).
Din, F.: “Thermodynamic Functions of Gases,” Butterworths. London, vol 2–3 (1962).
Author information
Authors and Affiliations
Rights and permissions
About this article
Cite this article
Yoo, KP. Regression of constrained parameters for nonlinear thermodynamic models. Korean J. Chem. Eng. 3, 77–81 (1986). https://doi.org/10.1007/BF02697527
Received:
Accepted:
Issue Date:
DOI: https://doi.org/10.1007/BF02697527