Evaluation of volatile iodine trapping in presence of contaminants: A periodic DFT study on cation exchanged-faujasite
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DOI: 10.1016/j.micromeso.2016.09.047
Abstract: Abstract Using periodic dispersion-corrected DFT calculations, the effect of potential inhibiting species (H 2 O, NO, CO, CH 3 Cl and Cl 2 ) on the adsorption of iodine species (I 2 , CH 3… read more here.
Keywords: exchanged faujasite; adsorption; cation exchanged; presence contaminants ... See more keywords
Composites of various cation exchanged forms of mesoporous zeolite A with polypyrrole-thermal, spectroscopic and gas sensing studies
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DOI: 10.1016/j.micromeso.2017.02.027
Abstract: Abstract Composites of polypyrrole with various cation exchanged forms of Zeolite A were successfully synthesized via chemical oxidative polymerization of Pyrrole (Py) in presence of a dispersion of A-zeolite (powder) in deionized water using anhydrous… read more here.
Keywords: cation; exchanged forms; various cation; gas ... See more keywords
Electrochemical Properties and Crystal Structure of Li+/H+ Cation-Exchanged LiNiO2
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DOI: 10.1021/acsaem.0c00602
Abstract: LiNiO2 has high energy density but readily reacts with moisture in the atmosphere and deteriorates. We performed qualitative and quantitative evaluations of the degraded phase of LiNiO2 and the inf... read more here.
Keywords: exchanged linio2; crystal structure; electrochemical properties; structure cation ... See more keywords
Theoretical studies on carbon dioxide adsorption in cation-exchanged molecular sieves
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DOI: 10.1039/d0ra05228k
Abstract: The capture and storage of the greenhouse gas, CO2, has attracted much interest from scientists in recent years. In this work, density functional theory (DFT) was used to study the adsorption of CO2 in different… read more here.
Keywords: adsorption; cation; exchanged zeolites; exchanged molecular ... See more keywords
Comparative compressional behavior of chabazite with Li+, Na+, Ag+, K+, Rb+, and Cs+ as extra-framework cations
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DOI: 10.2138/am-2018-6311
Abstract: Abstract The high-pressure behavior of monovalent-cation-exchanged chabazites was investigated by means of in situ synchrotron X-ray powder diffraction with a diamond-anvil cell, and using water as penetrating pressure-transmitting medium, up to 5.5 GPa at room… read more here.
Keywords: exchanged chabazites; extra framework; framework cations; cation exchanged ... See more keywords