Detection of hydrogen using graphene
| dc.contributor | Middle Tennessee State University. Physics and Astronomy Department. | en_US |
| dc.contributor.author | Ehemann, Robert C | en_US |
| dc.contributor.author | Krstić, Predrag S | en_US |
| dc.contributor.author | Dadras, Jonny | en_US |
| dc.contributor.author | Kent, Paul RC | en_US |
| dc.contributor.author | Jakowski, Jacek | en_US |
| dc.date.accessioned | 2014-06-24T15:41:58Z | |
| dc.date.available | 2014-06-24T15:41:58Z | |
| dc.date.issued | 2012-03-23 | en_US |
| dc.description.abstract | Irradiation dynamics of a single graphene sheet bombarded by hydrogen atoms is studied in the incident energy range of 0.1 to 200 eV. Results for reflection, transmission, and adsorption probabilities, as well as effects of a single adsorbed atom to the electronic properties of graphene, are obtained by the quantum-classical Monte Carlo molecular dynamics within a self-consistent-charge-density functional tight binding formalism We compare these results with those, distinctly different, obtained by the classical molecular dynamics. | en_US |
| dc.identifier.citation | Nanoscale Research Letters. 2012 Mar 23;7(1):198 | en_US |
| dc.identifier.uri | http://jewlscholar.mtsu.edu/handle/mtsu/4240 | |
| dc.rights | This is an Open Access article distributed under the terms of the Creative Commons Attribution Non-Commercial License which permits unrestricted non-commercial use, distribution, and reproduction in any medium, provided the original work is properly cited. | en_US |
| dc.subject | Graphene | en_US |
| dc.subject | DFTB | en_US |
| dc.subject | Hydrogen detection | en_US |
| dc.subject | HOMO-LUMO gap | en_US |
| dc.subject | Molecular dynamics | en_US |
| dc.title | Detection of hydrogen using graphene | en_US |
| dc.type | Research Article | en_US |
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