General mechanism for orbital selective phase transitions

Yu-Zhong Zhang, Hunpyo Lee, Hai-Qing Lin, Chang-Qin Wu, Harald O. Jeschke, and Roser Valentí
Phys. Rev. B 85, 035123 – Published 26 January 2012

Abstract

Based on the analysis of a two-orbital Hubbard model within a mean-field approach, we propose a mechanism for an orbital selective phase transition (OSPT) where coexistence of localized and itinerant electrons can be realized. We show that this OSPT exists both at and near half-filling even in the absence of crystal-field splittings or when bandwidths, orbital degeneracies, and magnetic states are equal for both orbitals, provided the orbitals have different band dispersions. Such conditions should generally be satisfied in many materials. We find that this OSPT is not sensitive to the strength of Hund's rule coupling and that heavy doping favors the collinear antiferromagnetic state over the OSPT. We discuss our results in relation to the iron pnictides.

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  • Received 8 November 2011

DOI:https://doi.org/10.1103/PhysRevB.85.035123

©2012 American Physical Society

Authors & Affiliations

Yu-Zhong Zhang1,*, Hunpyo Lee2, Hai-Qing Lin3, Chang-Qin Wu4, Harald O. Jeschke2, and Roser Valentí2

  • 1Shanghai Key Laboratory of Special Artificial Microstructure Materials and Technology, & Physics Department, Tongji University, Shanghai 200092, P.R. China
  • 2Institut für Theoretische Physik, Goethe-Universität Frankfurt, Max-von-Laue-Strasse 1, D-60438 Frankfurt/Main, Germany
  • 3Beijing Computational Science Research Center, Beijing 100084, China
  • 4Department of Physics and State Key Laboratory of Surface Physics, Fudan University, Shanghai 200433, China

  • *yzzhang@tongji.edu.cn

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Issue

Vol. 85, Iss. 3 — 15 January 2012

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