Magnetic properties of generalized polyallyl spin chain

Maksym Pokhmura, V. Cheranovskii
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Abstract

The work is devoted to the theoretical simulation of low-temperature magnetic properties of generalized polyallyl spin chain with the antiferromagnetic coupling of the neighboring spins (GPSC) - spin model of a family of quasi-one dimensional molecular ferrimagnets. First, the exact energy spectra of Heisenberg spin Hamiltonians of the finite lattice clusters of GPSC with the spins of the main chain s=1/2 and pendant spins š=1 have been studied by means of the exact diagonalization method. The calculations were performed for different positive values of the coupling parameters for neighboring spins of the main chain of GPSC clusters. On the base of the above exact energy spectra and the Boltzmann distribution law the field dependencies of magnetization of finite lattice clusters are calculated numerically at different temperatures. In the result, for low temperatures the presence of intermediate plateau in field dependencies of the cluster magnetization has been shown. These calculations demonstrated the stabilization of the intermediate magnetization plateau with the growth of the spin coupling along the main chain of GPSC clusters. In addition, the numerical study of temperature dependence of zero field magnetic susceptibility of 12- spin clusters of GPSC gives the results which are similar to the 1D model of molecular ferrimagnets like necklace spin ladder. Similar calculations of the magnetization profile were performed for infinite Heisenberg –Ising GPSC model with Ising type of the antiferromagnetic interactions between the neighboring spins of the main chain. The classical transfer- matrix method was used for this purpose. In the result, it was shown the presence of an intermediate plateau in the low-temperature magnetization profile of infinite chain model and the increase of the plateau size with increasing of the Ising coupling between the spins of the main chain.
广义聚烯丙基自旋链的磁性能
本文研究了一类准一维分子铁磁体的自旋模型——邻自旋反铁磁耦合广义聚烯丙基自旋链低温磁性能的理论模拟。首先,利用精确对角化方法,研究了主链自旋s=1/2、副链自旋s=1的GPSC有限晶格团簇的Heisenberg自旋哈密顿量的精确能谱。对GPSC簇主链相邻自旋的耦合参数取不同正值进行了计算。在上述精确能谱和玻尔兹曼分布定律的基础上,数值计算了有限晶格团簇在不同温度下磁化强度的场依赖关系。结果表明,在低温条件下,团簇磁化的场依赖性存在中间平台。这些计算表明,随着GPSC簇主链上自旋耦合的增长,中间磁化平台趋于稳定。此外,对GPSC的12-自旋团簇的零场磁化率的温度依赖性进行了数值研究,得到了类似于项链状自旋阶梯的分子铁磁体一维模型的结果。对具有主链相邻自旋之间的反铁磁相互作用的无限Heisenberg -Ising GPSC模型进行了类似的磁化谱计算。本文采用经典的传递矩阵法进行求解。结果表明,在无限链模型的低温磁化谱中存在一个中间平台,并且随着主链自旋之间Ising耦合的增加,平台的大小也随之增加。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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