Literature DB >> 21770658

Disproportionation and metallization at low-spin to high-spin transition in multiorbital Mott systems.

Jan Kuneš1, Vlastimil Křápek.   

Abstract

We study the thermally driven spin state transition in a two-orbital Hubbard model with crystal-field splitting, which provides a minimal description of the physics of LaCoO(3). We employ the dynamical mean-field theory with a quantum Monte Carlo impurity solver. At intermediate temperatures we find a spin disproportionated phase characterized by a checkerboard order of sites with small and large spin moments. The high temperature transition from the disproportionated to a homogeneous phase is accompanied by a vanishing of the charge gap. With the increasing crystal-field splitting the temperature range of the disproportionated phase shrinks and eventually disappears completely.

Year:  2011        PMID: 21770658     DOI: 10.1103/PhysRevLett.106.256401

Source DB:  PubMed          Journal:  Phys Rev Lett        ISSN: 0031-9007            Impact factor:   9.161


  2 in total

1.  Pressure-induced high-spin/low-spin disproportionated state in the Mott insulator FeBO3.

Authors:  Weiming Xu; Weiwei Dong; Samar Layek; Mark Shulman; Konstantin Glazyrin; Elena Bykova; Maxim Bykov; Michael Hanfland; Moshe P Pasternak; Ivan Leonov; Eran Greenberg; Gregory Kh Rozenberg
Journal:  Sci Rep       Date:  2022-06-10       Impact factor: 4.996

2.  Field-induced exciton condensation in LaCoO3.

Authors:  A Sotnikov; J Kuneš
Journal:  Sci Rep       Date:  2016-07-27       Impact factor: 4.379

  2 in total

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