ZEOMICS - Zeolite Pore Characterization Web Tool

ZEOMICS: Zeolites and Microporous Structures Characterization

ZEOMICS is an automated computational method for characterizing the three-dimensional porous networks of microporous materials, such as zeolites.

Browse Zeolite Structures

Linde Type A (zeolite A)
List all Structures

Upload Structure for Processing


Characterization Methods

Our web tool performs several algorithmic steps on each structure to generate the characterization. For a more detailed description of the methods, please refer to our publications below.


First, E. L., Gounaris, C. E., Wei, J., and Floudas, C. A. Computational characterization of zeolite porous networks: an automated approach. Physical Chemistry Chemical Physics, 13(38):17339–17358, 2011.

Gounaris, C. E., Wei, J., Floudas, C. A., Ranjan, R., and Tsapatsis, M. Rational design of shape selective separations and catalysis: Lattice relaxation and effective aperture size. AIChE Journal, 56(3):611–632, 2009.

Gounaris, C. E., Wei, J., and Floudas, C. A. Rational design of shape selective separation and catalysis–II: Mathematical model and computational studies. Chemical Engineering Science, 61(24):7949–7962, 2006.

Gounaris, C. E., Floudas, C. A., and Wei, J. Rational design of shape selective separation and catalysis–I: Concepts and analysis. Chemical Engineering Science, 61(24):7933–7948, 2006.

Related Work

For computational pore characterization of metal-organic frameworks (MOFs), please visit MOFomics.


This work is supported by the National Science Foundation (NSF EFRI-0937706).