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DFT-based microkinetic modeling of ethanol dehydration in H-ZSM-5
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Identification of intermediates in zeolite-catalyzed reactions by in situ UV/Vis microspectroscopy and a complementary set of molecular simulations
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Adsorption of C2-C8 n-alkanes in zeolites
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Theoretical simulations elucidate the role of naphthalenic species during methanol conversion within H-SAPO-34
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- Journal Article
- A1
- open access
Experimental and theoretical IR study of methanol and ethanol conversion over H-SAPO-34
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Theoretical study of the adsorption of C1-C4 primary alcohols in H-ZSM-5