| Автор | Abhijat Vichare |
| Автор | D G Kanhere |
| Дата выпуска | 1998-04-20 |
| dc.description | Ab initio molecular dynamical simulations have been performed to investigate the phenomenon of melting in a finite-size system, namely an cluster. Classical molecular dynamical simulations using Lennard-Jones potentials have shown that a coexistence region, where both solid-like and liquid-like behaviour is observed, exists over a range of total energy. Our density functional simulations on a metallic cluster aim at probing this coexistence region. Although our statistics is somewhat limited, we do find definite signatures of a coexistence region. |
| Формат | application.pdf |
| Издатель | Institute of Physics Publishing |
| Название | Density-based molecular dynamics study of melting in a finite-sized cluster: |
| Тип | paper |
| DOI | 10.1088/0953-8984/10/15/008 |
| Electronic ISSN | 1361-648X |
| Print ISSN | 0953-8984 |
| Журнал | Journal of Physics: Condensed Matter |
| Том | 10 |
| Первая страница | 3309 |
| Последняя страница | 3320 |
| Аффилиация | Abhijat Vichare; Department of Physics, University of Pune, Pune 411 007, India |
| Аффилиация | D G Kanhere; Department of Physics, University of Pune, Pune 411 007, India |
| Выпуск | 15 |
