Finite-Size Effects in Monte Carlo Simulations of the Gaussian Disorder Model

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초록

We study theoretical issues related to the use of finite size systems in Monte Carlo simulations of the Gaussian disorder model (GDM). The GDM is one of the most widely used models to describe the charge transport in random organic materials. In the GDM, the energy of charge carriers is well known to approach an equilibrium energy in the long-time limit. We find that at low temperatures, the equilibrium energy shows a strong dependence on the system size. Using improved numerical methods, we study system sizes much bigger than those used in earlier works. We show that, below a certain temperature, a system size much larger than those used in conventional studies must be used to correctly describe the temperature dependence of the equilibrium energy.

키워드

Charge transportRandom organic solidsGaussian disorder modelKinetic Monte Carlo methodCHARGE-TRANSPORTENERGYRELAXATIONDIFFUSIONTRANSITIONSYSTEMSSOLIDSSTATESSITESFIELD
제목
Finite-Size Effects in Monte Carlo Simulations of the Gaussian Disorder Model
저자
Kim, SunilYeo, JoonhyunIm, ChanKim, Doseok
DOI
10.3938/jkps.60.1897
발행일
2012-06
유형
Article
저널명
Journal of the Korean Physical Society
60
11
페이지
1897 ~ 1901