fit_temkinNLM {adsoRptionCMF} | R Documentation |
Temkin Isotherm Non-Linear Analysis
Description
Performs non-linear modeling for the Temkin adsorption isotherm.
Arguments
Ce |
numeric vector for equilibrium concentration |
Qe |
numeric vector for adsorbed amount |
Temp |
numeric value for temperature (in Kelvin) |
Value
A list containing the results of the non-linear Temkin model fitting, including:
-
Parameter estimates for the Temkin model (aT and bT).
-
Fit statistics such as Akaike Information Criterion (AIC), Bayesian Information Criterion (BIC), and R-squared.
-
Error metrics including Root Mean Square Error (RMSE), Mean Absolute Error (MAE), Mean Squared Error (MSE), Relative Absolute Error (RAE), and standard error of estimates.
A model fit plot with bootstrapped 95
A residual plot for diagnostic assessment of model performance.
Author(s)
Paul Angelo C. Manlapaz
References
Temkin, M.J., and Pyzhev, V. (1940). Kinetics of ammonia synthesis on promoted iron catalyst. Acta Phys. Chim. USSR 12, 327-356.
Examples
Ce <- c(0.01353, 0.04648, 0.13239, 0.27714, 0.41600, 0.63607, 0.80435, 1.10327, 1.58223)
Qe <- c(0.03409, 0.06025, 0.10622, 0.12842, 0.15299, 0.15379, 0.15735, 0.15735, 0.16607)
Temp <- 298
fit_temkinNLM(Ce, Qe, Temp)