Determination of kinetic parameters from TG curves by non-linear optimization

1981 ◽  
Vol 46 (3) ◽  
pp. 229-237 ◽  
Author(s):  
S. Boy ◽  
K. Böhme
Keyword(s):  
Kinetic Parameters ◽  
Linear Optimization ◽  
Non Linear

Application of non-linear heating regime for the determination of activation energy and kinetic parameters of solid-state reactions

1998 ◽  
Vol 323 (1-2) ◽  
pp. 101-107 ◽  
Author(s):  
K.V Tomashevitch ◽  
S.V Kalinin ◽  
A.A Vertegel ◽  
N.N Oleinikov ◽  
V.A Ketsko ◽  
...  
Keyword(s):  
Activation Energy ◽  
Solid State ◽  
Kinetic Parameters ◽  
Solid State Reactions ◽  
Heating Regime ◽  
Linear Heating ◽  
Non Linear

Determination of Total Energy Tight Binding Parameters from First Principles Calculations Using Adaptive Simulated Annealing

2001 ◽  
Vol 700 ◽  
Author(s):  
Anders G. Froseth ◽  
Peter Derlet ◽  
Ragnvald Hoier
Keyword(s):  
Simulated Annealing ◽  
Total Energy ◽  
First Principles ◽  
Linear Optimization ◽  
Tight Binding ◽  
Accurate Method ◽  
Optimization Method ◽  
Binding Parameters ◽  
Non Linear

AbstractEmpirical Total Energy Tight Binding (TETB) has proven to be a fast and accurate method for calculating materials properties for various system, including bulk, surface and amorphous structures. The determination of the tight binding parameters from first-principles results is a multivariate, non-linear optimization problem with multiple local minima. Simulated annealing is an optimization method which is flexible and “guaranteed” to find a global minimum, opposed to classical methods like non-linear least squares algorithms. As an example results are presented for a nonorthogonal s,p parameterization for Silicon based on the NRL tight binding formalism.

scholarly journals Determination of the Kinetic Constants of Glucose-6-phosphate 1-Epimerase by Non-Linear Optimization

1975 ◽  
Vol 50 (2) ◽  
pp. 419-424 ◽  
Author(s):  
Edwin M. CHANCE ◽  
Benno HESS ◽  
Theodor PLESSER ◽  
Bernd WURSTER
Keyword(s):  
Linear Optimization ◽  
Kinetic Constants ◽  
Non Linear

MEASUREMENT OF STEROID BINDING PROTEINS

1970 ◽  
Vol 65 (1_Suppl) ◽  
pp. S104-S121 ◽  
Author(s):  
E. E. Baulieu ◽  
J. P. Raynaud ◽  
E. Milgrom
Keyword(s):  
Kinetic Parameters ◽  
Binding Proteins ◽  
Binding Specificity ◽  
Binding Parameters ◽  
Target Organs ◽  
Biological Mixtures ◽  
Steroid Binding Proteins ◽  
Steroid Binding ◽  
Steroid Binding Protein

ABSTRACT A brief review of the characteristics of steroid binding proteins found in the plasma and in some target organs is presented, followed by some general remarks on binding »specificity« and binding parameters. Useful techniques for measuring binding parameters at equilibrium are reported, both those which keep the equilibrium intact and those which implicate its disruption. A concept is developed according to which the determination of a specific steroid binding protein is based on the »differential dissociation« of the several steroid binding complexes present in most biological mixtures. Methods which allow determination of the kinetic parameters of the binding systems are also presented. Various representations of the binding and therefore different modes of graphic representation and calculation are discussed, including the recent »proportion graph« method.

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