Density Functional Theory Study of Methyl Iodide Adsorption and Dissociation on Clean and K-Promoted β-Mo2C Surfaces-Reference-Cited by-同舟云学术

Density Functional Theory Study of Methyl Iodide Adsorption and Dissociation on Clean and K-Promoted β-Mo2C Surfaces

Published:2011-01-25 Issue:6 Volume:115 Page:2798-2804
ISSN:1932-7447
Container-title:The Journal of Physical Chemistry C
language:en
Short-container-title:J. Phys. Chem. C

Author:

Pronsato M. E.¹,Pistonesi C.¹,Juan A.¹,Farkas A. P.²,Bugyi L.²,Solymosi F.²

Affiliation:

1. Departamento de Física & IFISUR, Universidad Nacional del Sur-CONICET, Avda. Alem 1253, 8000 Bahía Blanca, Argentina

2. Reaction Kinetics Research Group, Chemical Research Centre of the Hungarian Academy of Sciences, University of Szeged, P.O. BOX 168, H-6701 Szeged, Hungary

Publisher

American Chemical Society (ACS)

Subject

Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials

Link

https://pubs.acs.org/doi/pdf/10.1021/jp110423w

Reference48 articles.

1. Embedded Diatomics-in-Molecules Potential Energy Function for Methyl Radical and Methane on Nickel Surfaces

2. Methyl on Cu(111)––structural determination including influence of co-adsorbed iodine

3. A DFT Study of Transition States for C−H Activation on the Ru(0001) Surface

4. Mimicking Aspects of Heterogeneous Catalysis: Generating, Isolating, and Reacting Proposed Surface Intermediates on Single Crystals in Vacuum

5. Organic chemistry on solid surfaces

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