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- W1964102989 abstract "Adsorption of dimethyl ether (DME) on the protonated ZSM-5 zeolite was investigated by FT-IR spectroscopy and density functional theory (DFT) calculation. The coverage and temperature dependencies of characteristic bands and the adsorption on the partially deuterated zeolite were studied by FT-IR. Three bands observed at ca. 2900, 2400, and 1600 cm-1 were ascribed to the bands associated with the Brønsted acidic OH groups hydrogen-bonded to DME, and the band at ca. 3300 cm-1 was assigned to the OH stretching mode of the silanol OH groups hydrogen-bonded to DME. Both the IR and DFT results indicated that DME molecules adsorbed on OH groups by a hydrogen bonding irrespective of the acidity of the OH groups and that the oxonium ions of DME were not produced on the studied surface. The Clausius−Clapeyron plot of the OH stretching band gave the value of −82.4 kJ/mol as ΔH, the energy of adsorption at the acidic site." @default.
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- W1964102989 date "1996-01-01" @default.
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- W1964102989 title "FT-IR and Quantum Chemical Studies of the Interaction between Dimethyl Ether and HZSM-5 Zeolite" @default.
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- W1964102989 doi "https://doi.org/10.1021/jp953127x" @default.
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