Why do gallium clusters have a higher melting point than the bulk?
Atomic and Molecular Clusters
2009-11-10 v2
Abstract
Density functional molecular dynamical simulations have been performed on Ga and Ga clusters to understand the recently observed higher-than-bulk melting temperatures in small gallium clusters [Breaux {\em et al.}, Phys. Rev. Lett. {\bf 91}, 215508 (2003)]. The specific-heat curve, calculated with the multiple-histogram technique, shows the melting temperature to be well above the bulk melting point of 303 K, viz. around 650 K and 1400 K for Ga and Ga, respectively. The higher-than-bulk melting temperatures are attributed mainly to the covalent bonding in these clusters, in contrast with the covalent-metallic bonding in the bulk.
Cite
@article{arxiv.physics/0312110,
title = {Why do gallium clusters have a higher melting point than the bulk?},
author = {S. Chacko and Kavita Joshi and D. G. Kanhere and S. A. Blundell},
journal= {arXiv preprint arXiv:physics/0312110},
year = {2009}
}
Comments
4 pages, including 6 figures. accepted for publication in Phys. Rev. Lett