Ab initio energy landscape of LiF clusters release_dxnzquy2czcfvbp7shp7ll64oe

by K. Doll, J. C. Schoen, M. Jansen

Released as a article .

2010  

Abstract

A global search for possible LiF cluster structures is performed, up to (LiF)8. The method is based on simulated annealing, where all the energies are evaluated on the ab initio level. In addition, the threshold algorithm is employed to determine the energy barriers for the transitions among these structures, for the cluster (LiF)4, again on the ab initio level; and the corresponding tree graph is obtained.
In text/plain format

Archived Files and Locations

application/pdf  1.0 MB
file_yaoxfrxpebgytne2jeddb4tcnu
arxiv.org (repository)
archive.org (archive)
web.archive.org (webarchive)
core.ac.uk (web)
Read Archived PDF
Preserved and Accessible
Type  article
Stage   submitted
Date   2010-07-20
Version   v1
Language   en ?
arXiv  1007.3356v1
Work Entity
access all versions, variants, and formats of this works (eg, pre-prints)
Catalog Record
Revision: bdef50ab-b2f5-4c9e-b8c1-16fc82dfa287
API URL: JSON