nonlinear parameter estimation (Toth model)

Community: MathModDB

computational task

nonlinear task

Available identifiers

MaRDI QIDQ6821163 FDOQ6821163

nonlinear estimation of Toth model parameters

Description

This task involves estimating the parameters of the Toth adsorption isotherm model from equilibrium adsorption data. The model is nonlinear in its parameters, so numerical regression techniques are required to obtain optimal values for the maximum adsorption capacity, equilibrium constant, and heterogeneity exponent. The goal is to minimize prediction error between experimental uptake data and the theoretical Toth curve. The task is typically implemented using nonlinear least-squares optimization. Estimated parameters are then used to characterize adsorption behavior on heterogeneous surfaces.

List of contained entities

Toth equilibrium constant
Toth heterogeneity exponent
Toth heterogeneity exponent constraint	$0<m_T\le 1$	constraint
	$m_T$ represents Toth heterogeneity exponent
Toth isotherm equation	$q_e=\frac{q_m{C}_e}{(\frac{1}{K_T}+C_e^{m_T}{)}^{\frac{1}{m_T}}}$
	$q_e$ represents adsorbed solute (equilibrium)
	$C_e$ represents solute concentration (equilibrium)
	$q_m$ represents maximum monolayer adsorption capacity
	$K_T$ represents Toth equilibrium constant
	$m_T$ represents Toth heterogeneity exponent
adsorbed solute (equilibrium)
maximum monolayer adsorption capacity
solute concentration (equilibrium)

Computational tasks specializing nonlinear parameter estimation (Toth model)

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Further items linking to nonlinear parameter estimation (Toth model)

Item	Property
Toth isotherm model	used by

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