Despite the great industrial importance
of zeolite LTA, there is
still a gap in characterization methods, based on adsorption related
to hindered diffusion of standard probe gases, such as N2 and Ar. LTA has a three-dimensional porous structure with a high
degree of symmetry; however, variations in the location of cations,
notably S2 and S3 sites, lead to different energy levels in supercages.
Herein, we propose to extend the pore type distribution (PTD) methodology,
recently applied for metal–organic frameworks, to zeolite materials.
As an application example, we selected Na-LTA (4A) zeolite. Structural
properties accessed by molecular simulation methods combined with
experimental adsorption isotherms of CO2 at 273 K determine
the individual contribution of supercages, with different energy levels,
to the total adsorption uptake. Using eight local isotherms from the
supercages, we developed a kernel that estimates the most likely energy
distribution levels among supercages from the best fits of experimental
isotherms. The method was applied in detail for LTA samples synthesized
in laboratory and supplied by an industrial manufacturer. As an extension
of the approach, we also analyze the use of the average local isotherm
in the determination of imperfections found in the synthesis of LTA
from unconventional raw materials or its deactivation in industrial
processes. The proposed methodology generates detailed and relevant
information not accessed by existing methods and allows the use of
adsorption to characterize this class of very small pore sieves.