A Novel Approach Using DFT to Explain the Selective Permeation of Small Gaseous Molecules through Y-Type Zeolite Membrane
- 5 November 1999
- journal article
- research article
- Published by American Chemical Society (ACS) in The Journal of Physical Chemistry A
- Vol. 103 (48) , 9857-9863
- https://doi.org/10.1021/jp991453x
Abstract
No abstract availableKeywords
This publication has 40 references indexed in Scilit:
- Ab Initio and Density Functional Theory Study of the Geometry and Reactivity of Benzyne, 3-Fluorobenzyne, 4-Fluorobenzyne, and 4,5-DidehydropyrimidineThe Journal of Physical Chemistry A, 1998
- Local Softness and Hardness Based Reactivity Descriptors for Predicting Intra- and Intermolecular Reactivity Sequences: Carbonyl CompoundsThe Journal of Physical Chemistry A, 1998
- Modeling of Adsorption Properties of Zeolites: Correlation with the StructureThe Journal of Physical Chemistry B, 1997
- Modeling of N2 and O2 Adsorption in ZeolitesThe Journal of Physical Chemistry, 1995
- Zeolite ZSM-5 membranes grown on porous α-Al2O3Journal of the Chemical Society, Chemical Communications, 1995
- The Hard and Soft Acids and Bases Principle: An Atoms in Molecules ViewpointThe Journal of Physical Chemistry, 1994
- A More Energy Efficient Product for Carbon Dioxide SeparationSeparation Science and Technology, 1993
- The separation and disposal of carbon dioxide from power station flue gasesEnergy Conversion and Management, 1992
- Development of flue gas carbon dioxide recovery technologyEnergy Conversion and Management, 1992
- Recent advances in the concept of hard and soft acids and basesJournal of Chemical Education, 1987