THE CO-ADSORPTION OF BENZENE ANDCOONCo(0001)-Reference-Cited by-同舟云学术

THE CO-ADSORPTION OF BENZENE ANDCOONCo(0001)

Published:2009-10 Issue:05 Volume:16 Page:749-755
ISSN:0218-625X
Container-title:Surface Review and Letters
language:en
Short-container-title:Surf. Rev. Lett.

Author:

GONZÁLEZ ESTELA A.¹,JASEN PAULA V.¹,PIERINI JORGE¹,BRIZUELA GRACIELA¹,JUAN ALFREDO¹

Affiliation:

1. Departamento de Física, Universidad Nacional del Sur, Av. Alem 1253, Bahía Blanca (8000), Argentina

Abstract

The co-adsorption of carbon monoxide and benzene on Co (0001) has been studied using density functional calculations. We used the ordered [Formula: see text] surface unit cell. A comparison of the co-adsorption with CO and benzene two-dimensional networks is also given. The electronic structure reveals that the CO orbitals interact with benzene and Co layer. Regarding the bonding, the Co–Co overlap population decrease 18% after benzene adsorption and increase a little after CO adsorption with a net 14.6% decrease in the co-adsorption system. The CO –benzene interaction is shown by the changes in the C – O ( CO ) and C – H (benzene) bonds.

Publisher

World Scientific Pub Co Pte Lt

Subject

Materials Chemistry,Surfaces, Coatings and Films,Surfaces and Interfaces,Condensed Matter Physics

Link

https://www.worldscientific.com/doi/pdf/10.1142/S0218625X09013104

Reference47 articles.

1. The adsorption of benzene mono- and multilayers on Ni(111) studied by TPD and LEED

2. A tensor LEED study of an unusual cyclic hydrocarbon intermediate formed by benzene adsorption on Co(101̄0)

3. THE UNUSUAL ADSORPTION BEHAVIOUR OF BENZENE ON ${\rm Co}(10{\bar 1}0)$

4. The electronic structure of benzene adsorbed on thin Fe(110) and Co(0001) films

Cited by 4 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Insights into NinTim clusters adsorption and diffusion on B2-NiTi phase from atomistic simulations;Surface Science;2020-11

2. Benzene Adsorption on Rh(111): A New Perspective on Intermolecular Interactions and Molecular Ordering;The Journal of Physical Chemistry C;2018-05-07

3. DFT study of benzene and CO co-adsorption on PtCo(111);Applied Surface Science;2014-01

4. Benzene adsorption on PtCo(111): A DFT study;Applied Surface Science;2013-10