Exact and density matrix renormalization group studies of two mixed spin-(12,52,12) branched-chain models developed for a heterotrimetallic Fe-Mn-Cu coordination polymer

Fabiana Souza, Luan M. Veríssimo, Jozef Strečka, Marcelo L. Lyra, and Maria S. S. Pereira
Phys. Rev. B 102, 064414 – Published 17 August 2020

Abstract

The mixed-spin Ising-Heisenberg and Heisenberg branched chains whose magnetic backbone consists of regularly alternating spins 1/2 and 5/2, the latter of which are additionally coupled to an extra spin 1/2 providing lateral branching, are investigated using exact analytical and density matrix renormalization group (DMRG) methods. The proposed spin-chain models capture some relevant aspects of the heterotrimetallic coordination polymer [CuMn(L)][Fe(bpb)(CN)2]·ClO4·H2O. The mixed spin-(1/2,5/2,1/2) Ising-Heisenberg branched chain is exactly solvable under the assumption of an Ising-like exchange coupling along the chain, while the lateral branching is treated as an anisotropic XXZ Heisenberg exchange interaction. We determine the ground-state phase diagram and quantify a bipartite quantum entanglement between dimers at lateral branching. It is shown that the studied mixed-spin Ising-Heisenberg branched chain accurately fits available experimental data for temperature dependence of the magnetic susceptibility. The ground-state phase diagram of the analogous mixed spin-(1/2,5/2,1/2) Heisenberg branched chain is obtained within the DMRG method. The ground-state phase diagrams of the Ising-Heisenberg and its full Heisenberg counterpart are contrasted. In particular, the ground-state phase diagram of the mixed-spin Heisenberg branched chain involves a special Gaussian critical point, for which a proper finite-size scaling analysis is provided to accurately estimate its location and the correlation length critical exponent.

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  • Received 23 May 2020
  • Revised 30 July 2020
  • Accepted 4 August 2020

DOI:https://doi.org/10.1103/PhysRevB.102.064414

©2020 American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Fabiana Souza1, Luan M. Veríssimo1, Jozef Strečka2, Marcelo L. Lyra1, and Maria S. S. Pereira1

  • 1Instituto de Física, Universidade Federal de Alagoas, 57072-970 Maceió, Alagoas, Brazil
  • 2Department of Theoretical Physics and Astrophysics, Faculty of Science, P. J. Šafárik University, Park Angelinum 9, 040 01 Košice, Slovakia

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Vol. 102, Iss. 6 — 1 August 2020

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