Monte Carlo study on critical exponents of the classical Heisenberg model in ferromagnetic icosahedral quasicrystal

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Main Authors: Watanabe, Shinji, Yamada, Tsunetomo, Takakura, Hiroyuki, Fujita, Nobuhisa
Format: Preprint
Published: 2025
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_version_ 1866914121757229056
author Watanabe, Shinji
Yamada, Tsunetomo
Takakura, Hiroyuki
Fujita, Nobuhisa
author_facet Watanabe, Shinji
Yamada, Tsunetomo
Takakura, Hiroyuki
Fujita, Nobuhisa
contents Quasicrystals (QCs) lack three-dimensional periodicity of atomic arrangement but possess long-range structural order, which are distinct from periodic crystals and random systems. Here, we show how the ferromagnetic (FM) order arises in the icosahedral QC (i-QC) on the basis of the Monte Carlo simulation of the Heisenberg model on the Yb lattice of Cd$_{5.7}$Yb composed of regular icosahedrons. By finite-size scaling of the Monte Carlo data, we identified the critical exponents of the magnetization, magnetic susceptibility, and spin correlation length, $β=0.508(30)$, $γ=1.361(59)$, and $ν=0.792(17)$, respectively. We confirmed that our data satisfy the hyperscaling relation and estimated the other critical exponents $α=-0.376(51)$, $δ=3.68(23)$, and $η=0.282(65)$. These results show a new universality class inherent in the i-QC, which is different from those in periodic magnets and spin glasses. In the i-QC, each Yb site at vertices of the regular icosahedrons is classified into 8 classes with respect to the coordination numbers of the nearest-neighbor and next-nearest-neighbor bonds. We revealed the FM-transition mechanism by showing that the difference in the local environment of each site is governed by cooperative evolution of spin correlations upon cooling, giving rise to the critical phenomena.
format Preprint
id arxiv_https___arxiv_org_abs_2510_25169
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Monte Carlo study on critical exponents of the classical Heisenberg model in ferromagnetic icosahedral quasicrystal
Watanabe, Shinji
Yamada, Tsunetomo
Takakura, Hiroyuki
Fujita, Nobuhisa
Strongly Correlated Electrons
Materials Science
Statistical Mechanics
Quasicrystals (QCs) lack three-dimensional periodicity of atomic arrangement but possess long-range structural order, which are distinct from periodic crystals and random systems. Here, we show how the ferromagnetic (FM) order arises in the icosahedral QC (i-QC) on the basis of the Monte Carlo simulation of the Heisenberg model on the Yb lattice of Cd$_{5.7}$Yb composed of regular icosahedrons. By finite-size scaling of the Monte Carlo data, we identified the critical exponents of the magnetization, magnetic susceptibility, and spin correlation length, $β=0.508(30)$, $γ=1.361(59)$, and $ν=0.792(17)$, respectively. We confirmed that our data satisfy the hyperscaling relation and estimated the other critical exponents $α=-0.376(51)$, $δ=3.68(23)$, and $η=0.282(65)$. These results show a new universality class inherent in the i-QC, which is different from those in periodic magnets and spin glasses. In the i-QC, each Yb site at vertices of the regular icosahedrons is classified into 8 classes with respect to the coordination numbers of the nearest-neighbor and next-nearest-neighbor bonds. We revealed the FM-transition mechanism by showing that the difference in the local environment of each site is governed by cooperative evolution of spin correlations upon cooling, giving rise to the critical phenomena.
title Monte Carlo study on critical exponents of the classical Heisenberg model in ferromagnetic icosahedral quasicrystal
topic Strongly Correlated Electrons
Materials Science
Statistical Mechanics
url https://arxiv.org/abs/2510.25169