Adsorption structure of dimethyl ether on silicalite-1 zeolite determined using single-crystal X-ray diffraction
| العنوان: | Adsorption structure of dimethyl ether on silicalite-1 zeolite determined using single-crystal X-ray diffraction |
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| المؤلفون: | Koji Nishi, Yoshinobu Yokomori, Natsumi Kamiya, Shintaro Seino, Shinjiro Fujiyama |
| المصدر: | Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials |
| بيانات النشر: | International Union of Crystallography (IUCr), 2014. |
| سنة النشر: | 2014 |
| مصطلحات موضوعية: | Stereochemistry, dimethyl ether, macromolecular substances, complex mixtures, single-crystal structure analysis, symbols.namesake, chemistry.chemical_compound, Adsorption, Materials Chemistry, silicalite-1, Molecule, Dimethyl ether, Zeolite, adsorption structure, Chemistry, Metals and Alloys, MFI-type zeolite, Sorption, Research Papers, Atomic and Molecular Physics, and Optics, Electronic, Optical and Magnetic Materials, X-ray crystallography, symbols, Physical chemistry, van der Waals force, Single crystal |
| الوصف: | The most stable sorption site of dimethyl ether on silicalite-1 is the sinusoidal channel. The configuration of guest molecules (linear or bent) plays an important role in determining where the stable sorption site is situated. The adsorption structures of dimethyl ether (DME) on silicalite-1 zeolite (MFI-type) are determined using single-crystal X-ray diffraction. The structure of low-loaded DME-silicalite-1 indicates that all DME molecules are located in the sinusoidal channel, which is the most stable sorption site based on the van der Waals interaction between DME and the framework. The configuration of guest molecules (linear or bent) plays an important role in determining where the stable sorption site is in the pore system of MFI-type zeolites. Bent molecules favor the sinusoidal channel, while linear molecules favor the straight channel. The contribution of DME–DME interactions is considerable in the high-loaded DME-silicalite-1 structure. |
| تدمد: | 2052-5206 |
| URL الوصول: | https://explore.openaire.eu/search/publication?articleId=doi_dedup___::fd880234fdb80238191458def9d370b0 https://doi.org/10.1107/s2052520614015911 |
| حقوق: | OPEN |
| رقم الأكسشن: | edsair.doi.dedup.....fd880234fdb80238191458def9d370b0 |
| قاعدة البيانات: | OpenAIRE |
| تدمد: | 20525206 |
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