relation: http://d-scholarship-dev.library.pitt.edu/17963/
title: Global optimization and finite temperature simulations of atomic clusters: Use of XenArm clusters as test systems
creator: Munro, LJ
creator: Tharrington, A
creator: Jordan, KD
description: The large potential energy barriers separating local minima on the potential energy surface of cluster systems pose serious problems for optimization and simulation methods. This article discusses algorithms for dealing with these problems. Lennard-Jones clusters are used to illustrate the important issues. In addition, the complexities in going from one-component to binary Lennard-Jones clusters are explored. © 2001 Elsevier Science B.V. All rights reserved.
date: 2002-05-01
type: Article
type: PeerReviewed
format: text/plain
language: en
rights: attached
identifier: http://d-scholarship-dev.library.pitt.edu/17963/1/licence.txt
identifier: Munro, LJ and Tharrington, A and Jordan, KD (2002) Global optimization and finite temperature simulations of atomic clusters: Use of XenArm clusters as test systems. Computer Physics Communications, 145 (1). 1 - 23. ISSN 0010-4655
relation: 10.1016/S0010-4655(01)00430-1