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A study by IETS of the chemisorption of benzotriazole and benzimidazole on plasma-grown aluminium and magnesium oxides

โœ Scribed by N.M.D. Brown; B.J. Meenan; G.M. Taggart


Publisher
Elsevier Science
Year
1991
Tongue
English
Weight
619 KB
Volume
47
Category
Article
ISSN
1386-1425

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The reaction of a methane molecule with a lithium-doped magnesium oxide catalyst (Li/MgO) containing small amounts of Znzt cations (Zn/Li/MgO) was theoretically studied using a modified MIND0/3 method and applying a supermolecular approach. The surface of magnesium oxide (MgO) was modelled by a MgX2