Characteristic regions on the energy landscape of MgF2

Citation
Mac. Wevers et al., Characteristic regions on the energy landscape of MgF2, J PHYS A, 34(19), 2001, pp. 4041-4052
Citations number
43
Categorie Soggetti
Physics
Journal title
JOURNAL OF PHYSICS A-MATHEMATICAL AND GENERAL
ISSN journal
03054470 → ACNP
Volume
34
Issue
19
Year of publication
2001
Pages
4041 - 4052
Database
ISI
SICI code
0305-4470(20010518)34:19<4041:CROTEL>2.0.ZU;2-H
Abstract
High-dimensional energy landscapes of complex systems often exhibit a very complicated structure, with many local minima separated by a multitude of b arriers of various heights. For the analysis of the dynamics on such landsc apes, simplified models based on combining many microstates to form physica lly relevant macrostates are of great advantage. In particular, knowledge o f the relative sizes of minimum and transition regions is crucial. As an ex ample, we analyse transitions in low-energy regions belonging to a simple m odel of the crystalline compound MgF2. We find that the minimum regions, i. e. the states associated with only one particular minimum, extend to energi es far above the saddle points, and we show that the size of the transition regions is small compared with the minimum regions.