Models for one-dimensional molecular magnets

被引:2
|
作者
Reis, M. S. [1 ]
机构
[1] Univ Fed Fluminense, Inst Fis, BR-24210346 Niteroi, RJ, Brazil
关键词
Molecular magnets; Magnetic chains; Computational routine; HEISENBERG CHAIN; ALTERNATION; ANISOTROPY; SPIN; S=1;
D O I
10.1016/j.cpc.2011.09.003
中图分类号
TP39 [计算机的应用];
学科分类号
081203 ; 0835 ;
摘要
Since the middle of the last century several models have been developed to describe the magnetic properties of one-dimensional (chain) systems. On the other hand, during the last decades several important synthesis techniques have also been developed and new materials with low-dimensional character appeared; and thus, those models tested. However, nowadays, there is a plant of new materials, with potential applications, requiring an efficient and fast magnetic characterization. This is the aim of the present paper, to provide a fully automatized routine, added to the CARDAMOMO package, to analyze eight different magnetic chains, including uni- and duo-metallic, regular and irregular chains. (C) 2011 Elsevier B.V. All rights reserved.
引用
收藏
页码:99 / 105
页数:7
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