Two-level Ising-like model for spin-crossover phenomenon including the magnetic field effect:: the mean-field approximation and Monte Carlo resolutions

被引:10
作者
Conséjo, C
Molnár, G
Goiran, M
Bousseksou, A
机构
[1] CNRS, UPR 8241, Lab Chim Coodinat, F-31077 Toulouse, France
[2] UPS, INSA, CNRS, Lab Natl Champs Magnet Pulses, F-31077 Toulouse, France
关键词
spin-crossover; bistability; magnetic field effect; Ising-like model; Monte Carlo;
D O I
10.1016/S0277-5387(03)00293-6
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
In this paper we analysed the magnetic field effect on the spin-crossover phenomenon using different theoretical approaches: thermodynamic and Ising-like models. This latter, including magnetic field, was treated in the mean-field approximation and-for the first time-by Monte Carlo numerical method. We propose an adaptation of the metropolis algorithm to take into account the different degeneracies of the high and low-spin levels and their Zeeman splitings due to the effect of magnetic field in both states. A comparison of both methods is given and discussed. (C) 2003 Elsevier Science Ltd. All rights reserved.
引用
收藏
页码:2441 / 2446
页数:6
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