pyapep 0.1.8

Python package for adsorption process simulations

pyAPEP Package Reference

pyAPEP (Python Adsorption Process Evaluation Package) is an all-in-one toolkit for evaluating adsorbent performance through process simulation. It comprises three main modules, each corresponding to a subpackage:

• pyAPEP.isofit – Isotherm fitting module for deriving isotherm models from data.
• pyAPEP.simide – Ideal PSA (Pressure Swing Adsorption) simulation module under idealized conditions.
• pyAPEP.simsep – Real PSA simulation module accounting for non-ideal effects (mass transfer, pressure drop, heat).

Below is a detailed reference for all public functions and classes in these subpackages, including their purpose and parameters.

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Table of Contents

1. pyAPEP.isofit – Isotherm Fitting Module
   • best_isomodel(P, q, iso_par_nums, iso_fun_lists, iso_fun_index, tol)
   • fit_diffT(p_list, q_list, T_list, i_ref, iso_par_nums, iso_fun_lists, iso_fun_index, tol)
   • IAST(isotherm_list, P_i, T)
2. pyAPEP.simide – Ideal PSA Simulation Module
   • IdealColumn (class)
3. pyAPEP.simsep – Real PSA Simulation Module
   • column (class)
   • Pressure Equalization Functions
4. Additional Information

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pyAPEP.isofit – Isotherm Fitting Module

The isofit module is used to define adsorption isotherm functions from pressure–uptake data. It provides functions to automatically fit isotherm models to data, handle multi-temperature isotherm fitting, and predict mixture isotherms using Ideal Adsorbed Solution Theory (IAST).

best_isomodel

best_isomodel(P, q, iso_par_nums=[2, 3, 4], iso_fun_lists=None, iso_fun_index=None, tol=1e-05)