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Adsorption and dehydration of ethanol on isomorphously B, Al, and Ga substituted H-ZSM-5 zeolite: an embedded ONIOM study

Nattida Maeboonruan, Bundet Boekfa, Thana Maihom, Piti Treesukol, Kanokwan Kongpatpanich, Supawadee Namuangruk‬, Michael Probst, Jumras Limtrakul

2021Journal of Molecular Modeling13 citationsDOI

Topics & Concepts

ONIOMChemistryZSM-5ZeoliteCatalysisDehydrationEthyleneAdsorptionReaction mechanismEthanolConcerted reactionInorganic chemistryOrganic chemistryBiochemistryZeolite Catalysis and SynthesisCatalytic Processes in Materials ScienceCatalysis for Biomass Conversion
Adsorption and dehydration of ethanol on isomorphously B, Al, and Ga substituted H-ZSM-5 zeolite: an embedded ONIOM study | Litcius