Abstract <p>An extensive Monte Carlo study of the classical Heisenberg model on a simple cubic lattice with antiferromagnetic exchange interactions <InlineEquation ID="IEq1"> <EquationSource Format="TEX">\({{J}_{n}}\)</EquationSource> <!--PhysMet2560277Ignatenko-m1--> </InlineEquation> between the first, second, and third neighbors is performed in a broad region of <InlineEquation ID="IEq2"> <EquationSource Format="TEX">\({{{{J}_{2}}} \mathord{\left/ {\vphantom {{{{J}_{2}}} {{{J}_{1}}}}} \right. \kern-0em} {{{J}_{1}}}}\)</EquationSource> <!--PhysMet2560277Ignatenko-m2--> </InlineEquation>, <InlineEquation ID="IEq3"> <EquationSource Format="TEX">\({{{{J}_{3}}} \mathord{\left/ {\vphantom {{{{J}_{3}}} {{{J}_{1}}}}} \right. \kern-0em} {{{J}_{1}}}}\)</EquationSource> <!--PhysMet2560277Ignatenko-m3--> </InlineEquation> ratios, and temperature. The character of the phase transitions is analyzed via the Binder cumulant method. The Néel temperature <InlineEquation ID="IEq4"> <EquationSource Format="TEX">\({{T}_{{\text{N}}}}\)</EquationSource> <!--PhysMet2560277Ignatenko-m4--> </InlineEquation> and the frustration parameter (the ratio <InlineEquation ID="IEq5"> <EquationSource Format="TEX">\(f = {{\left| \theta \right|} \mathord{\left/ {\vphantom {{\left| \theta \right|} {{{T}_{{\text{N}}}}}}} \right. \kern-0em} {{{T}_{{\text{N}}}}}}\)</EquationSource> <!--PhysMet2560277Ignatenko-m5--> </InlineEquation>, <InlineEquation ID="IEq6"> <EquationSource Format="TEX">\(\theta \)</EquationSource> <!--PhysMet2560277Ignatenko-m6--> </InlineEquation> being the Curie–Weiss temperature) are calculated. A comparison with the Tyablikov approximation is carried out. The strength of the frustration effects is explored. Possible applications to antiferromagnetic perovskites, such as CaMnO<sub>3</sub> and HgMnO<sub>3</sub>, are discussed.</p>

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Monte Carlo Study of the Classical Antiferromagnetic J1J2J3 Heisenberg Model on a Simple Cubic Lattice

  • A. N. Ignatenko,
  • S. V. Streltsov,
  • V. Yu. Irkhin

摘要

Abstract

An extensive Monte Carlo study of the classical Heisenberg model on a simple cubic lattice with antiferromagnetic exchange interactions \({{J}_{n}}\) between the first, second, and third neighbors is performed in a broad region of \({{{{J}_{2}}} \mathord{\left/ {\vphantom {{{{J}_{2}}} {{{J}_{1}}}}} \right. \kern-0em} {{{J}_{1}}}}\) , \({{{{J}_{3}}} \mathord{\left/ {\vphantom {{{{J}_{3}}} {{{J}_{1}}}}} \right. \kern-0em} {{{J}_{1}}}}\) ratios, and temperature. The character of the phase transitions is analyzed via the Binder cumulant method. The Néel temperature \({{T}_{{\text{N}}}}\) and the frustration parameter (the ratio \(f = {{\left| \theta \right|} \mathord{\left/ {\vphantom {{\left| \theta \right|} {{{T}_{{\text{N}}}}}}} \right. \kern-0em} {{{T}_{{\text{N}}}}}}\) , \(\theta \) being the Curie–Weiss temperature) are calculated. A comparison with the Tyablikov approximation is carried out. The strength of the frustration effects is explored. Possible applications to antiferromagnetic perovskites, such as CaMnO3 and HgMnO3, are discussed.