A van der Waals Inclusive Density Functional Theory Study of the Nature of Bonding for Thiophene Adsorption on Ni(100) and Cu(100) Surfaces

Walter Malone; Handan Yildirim; Jeronimo Matos; Abdelkader Kara; Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). National Energy Research Scientific Computing Center (NERSC)

doi:10.1021/acs.jpcc.6b12064

Back

A van der Waals Inclusive Density Functional Theory Study of the Nature of Bonding for Thiophene Adsorption on Ni(100) and Cu(100) Surfaces

Journal article

Peer reviewed

A van der Waals Inclusive Density Functional Theory Study of the Nature of Bonding for Thiophene Adsorption on Ni(100) and Cu(100) Surfaces

Walter Malone, Handan Yildirim, Jeronimo Matos, Abdelkader Kara and Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). National Energy Research Scientific Computing Center (NERSC)

Journal of physical chemistry. C, Vol.121(11), pp.6090-6103

23/03/2017

DOI: https://doi.org/10.1021/acs.jpcc.6b12064

Metrics

1 Record Views

Details

Title: A van der Waals Inclusive Density Functional Theory Study of the Nature of Bonding for Thiophene Adsorption on Ni(100) and Cu(100) Surfaces
Creators - without role: Walter Malone - University of Central Florida
Handan Yildirim - University of Central Florida
Jeronimo Matos - University of Central Florida
Abdelkader Kara - University of Central Florida
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). National Energy Research Scientific Computing Center (NERSC)
Publication Details: Journal of physical chemistry. C, Vol.121(11), pp.6090-6103
Identifiers: 9915855008331
Academic Unit: Imam Abdulrahman Bin Faisal University
Language: English
Resource Type: Journal article