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Electronic effects of chemisorption on a powdered zinc oxide catalyst

โœ Scribed by Chong, V. M. ;Connoy, J. V. ;Mark, P.


Publisher
John Wiley and Sons
Year
1972
Tongue
English
Weight
189 KB
Volume
9
Category
Article
ISSN
0031-8965

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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