Modification of Phonon Spectral Densities of the (001) Copper Surface Due to Copper Adatoms by Molecular-Dynamics Simulation
dc.contributor.author | Papanicolaou, N. I. | en |
dc.contributor.author | Lagaris, I. E. | en |
dc.contributor.author | Evangelakis, G. A. | en |
dc.date.accessioned | 2015-11-24T17:02:12Z | |
dc.date.available | 2015-11-24T17:02:12Z | |
dc.identifier.issn | 0039-6028 | - |
dc.identifier.uri | https://olympias.lib.uoi.gr/jspui/handle/123456789/11023 | |
dc.rights | Default Licence | - |
dc.subject | adatoms | en |
dc.subject | copper | en |
dc.subject | molecular dynamics simulation | en |
dc.subject | phonons | en |
dc.subject | vibrations of adsorbed atoms | en |
dc.subject | embedded-atom method | en |
dc.subject | transition-metals | en |
dc.subject | computer-simulation | en |
dc.subject | fcc transition | en |
dc.subject | defects | en |
dc.subject | cu(100) | en |
dc.subject | anharmonicity | en |
dc.subject | disorder | en |
dc.subject | cu(001) | en |
dc.subject | cu(110) | en |
dc.title | Modification of Phonon Spectral Densities of the (001) Copper Surface Due to Copper Adatoms by Molecular-Dynamics Simulation | en |
heal.abstract | Phonon spectral densities of the (001) copper surface containing copper adatoms have been calculated at various temperatures using molecular dynamics simulation. The results reveal that the presence of adatoms is manifested mainly by the appearance of new dispersionless peaks which are broadened and shifted to lower energies as the temperature increases. The existent experimental results, as well as lattice dynamics, ab initio calculations and other simulations in the case of a clean surface, are in good agreement with our predictions. | en |
heal.access | campus | - |
heal.fullTextAvailability | TRUE | - |
heal.journalName | Surface Science | en |
heal.journalType | peer reviewed | - |
heal.language | en | - |
heal.publicationDate | 1995 | - |
heal.recordProvider | Πανεπιστήμιο Ιωαννίνων. Σχολή Θετικών Επιστημών. Τμήμα Μηχανικών Ηλεκτρονικών Υπολογιστών και Πληροφορικής | el |
heal.type | journalArticle | - |
heal.type.el | Άρθρο Περιοδικού | el |
heal.type.en | Journal article | en |
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