Nonlinear parameter estimation (Langmuir adsorption model)

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Community: MathModDB

computational task nonlinear task

Available identifiers

MaRDI QIDQ6775767 FDOQ6775767

named after Irving Langmuir




This task performs nonlinear parameter estimation using experimental adsorption equilibrium data. The objective is to determine the Langmuir adsorption constant and maximum monolayer adsorption capacity by fitting the nonlinear Langmuir equation directly to measured solute concentration and adsorbed amount data. The results quantify the adsorption affinity and monolayer capacity of the adsorbent without bias from linearization.

Contained entities

solute concentration (equilibrium)
adsorbed solute (equilibrium)
maximum monolayer adsorption capacity
Langmuir adsorption constant KLkakd output
KL represents Langmuir adsorption constant
ka represents adsorption rate constant
kd represents desorption rate constant
Langmuir equation qe=qmKLCe1+KLCe
θ=KLCe1+KLCe
qe=qmKLpe1+KLpe
θ=KLpe1+KLpe
qe represents adsorbed solute (equilibrium)
Ce represents solute concentration (equilibrium)
KL represents Langmuir adsorption constant
qm represents maximum monolayer adsorption capacity
θ represents fractional surface coverage
pe represents adsorbate partial pressure (equilibrium)




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