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Title: Electronic origin of the spin-phonon coupling effect in transition-metal perovskites

Authors:
; ; ; ;
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
1375265
Grant/Contract Number:  
SC0012575; AC02-05CH11231
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
Physical Review B
Additional Journal Information:
Journal Name: Physical Review B Journal Volume: 96 Journal Issue: 7; Journal ID: ISSN 2469-9950
Publisher:
American Physical Society
Country of Publication:
United States
Language:
English

Citation Formats

Wang, Hongwei, He, Lixin, Jiang, Hong, Steele, Cameron, and Wu, Xifan. Electronic origin of the spin-phonon coupling effect in transition-metal perovskites. United States: N. p., 2017. Web. doi:10.1103/PhysRevB.96.075121.
Wang, Hongwei, He, Lixin, Jiang, Hong, Steele, Cameron, & Wu, Xifan. Electronic origin of the spin-phonon coupling effect in transition-metal perovskites. United States. doi:10.1103/PhysRevB.96.075121.
Wang, Hongwei, He, Lixin, Jiang, Hong, Steele, Cameron, and Wu, Xifan. Fri . "Electronic origin of the spin-phonon coupling effect in transition-metal perovskites". United States. doi:10.1103/PhysRevB.96.075121.
@article{osti_1375265,
title = {Electronic origin of the spin-phonon coupling effect in transition-metal perovskites},
author = {Wang, Hongwei and He, Lixin and Jiang, Hong and Steele, Cameron and Wu, Xifan},
abstractNote = {},
doi = {10.1103/PhysRevB.96.075121},
journal = {Physical Review B},
number = 7,
volume = 96,
place = {United States},
year = {2017},
month = {8}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record
DOI: 10.1103/PhysRevB.96.075121

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Cited by: 1 work
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Works referenced in this record:

Strong spin-phonon coupling in infrared and Raman spectra of SrMnO 3
journal, February 2014


Infrared and terahertz studies of polar phonons and magnetodielectric effect in multiferroic Bi Fe O 3 ceramics
journal, January 2007


Applications of critical temperature in minimizing functions of continuous variables with simulated annealing algorithm
journal, January 2010


Large spin-phonon coupling and magnetically induced phonon anisotropy in Sr M O 3 perovskites ( M = V ,Cr,Mn,Fe,Co)
journal, September 2011


Maximally localized Wannier functions: Theory and applications
journal, October 2012

  • Marzari, Nicola; Mostofi, Arash A.; Yates, Jonathan R.
  • Reviews of Modern Physics, Vol. 84, Issue 4
  • DOI: 10.1103/RevModPhys.84.1419

Epitaxial-Strain-Induced Multiferroicity in SrMnO 3 from First Principles
journal, May 2010


Multiferroics of spin origin
journal, July 2014


Bulk magnetoelectricity in the hexagonal manganites and ferrites
journal, January 2014

  • Das, Hena; Wysocki, Aleksander L.; Geng, Yanan
  • Nature Communications, Vol. 5, Issue 1
  • DOI: 10.1038/ncomms3998

Magnetically Induced Phonon Anisotropy in ZnCr 2 O 4 from First Principles
journal, May 2006


The manifestation of spin-phonon coupling in CaMnO 3
journal, April 2015

  • Goian, V.; Kamba, S.; Borodavka, F.
  • Journal of Applied Physics, Vol. 117, Issue 16
  • DOI: 10.1063/1.4918659

Spin-phonon coupling effects in transition-metal perovskites: A DFT +  U and hybrid-functional study
journal, February 2012


Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
journal, October 1996


First principles phonon calculations in materials science
journal, November 2015


The magnetoelectric effect in transition metal oxides: Insights and the rational design of new materials from first principles
journal, October 2012

  • Birol, Turan; Benedek, Nicole A.; Das, Hena
  • Current Opinion in Solid State and Materials Science, Vol. 16, Issue 5
  • DOI: 10.1016/j.cossms.2012.08.002

Infrared and magnetic characterization of multiferroic Bi 2 Fe Cr O 6 thin films over a broad temperature range
journal, March 2008


A strong ferroelectric ferromagnet created by means of spin–lattice coupling
journal, August 2010

  • Lee, June Hyuk; Fang, Lei; Vlahos, Eftihia
  • Nature, Vol. 466, Issue 7309
  • DOI: 10.1038/nature09331

Octahedral Tilting in Perovskites. I. Geometrical Considerations
journal, February 1997


First-principles LDA + U and GGA + U study of cerium oxides: Dependence on the effective U parameter
journal, January 2007


The Jahn-Teller effect and magnetism: transition metal compounds
journal, April 1982


Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces
journal, April 2008


Coupled Magnetic-Ferroelectric Metal-Insulator Transition in Epitaxially Strained SrCoO 3 from First Principles
journal, August 2011


Interface enhancement of spin-polar phonon coupling in perovskite multiferroic superlattices
journal, October 2012


Electronic Structure, Phonons, and Dielectric Anomaly in Ferromagnetic Insulating Double Pervoskite La 2 NiMnO 6
journal, May 2008


Apparent Ionic Charges and Vibrational Eigenmodes of BaTi O 3 and Other Perovskites
journal, May 1967


Magnetic and Electric Phase Control in Epitaxial EuTiO 3 from First Principles
journal, December 2006


Superexchange interaction and symmetry properties of electron orbitals
journal, July 1959


Multiferroics: Past, present, and future
journal, October 2010

  • Spaldin, Nicola A.; Cheong, Sang-Wook; Ramesh, Ramamoorthy
  • Physics Today, Vol. 63, Issue 10
  • DOI: 10.1063/1.3502547

Engineering Multiferroism in CaMnO 3
journal, March 2009


Structural and electronic origin of the magnetic structures in hexagonal LuFeO 3
journal, July 2014


Multiferroics: a magnetic twist for ferroelectricity
journal, January 2007

  • Cheong, Sang-Wook; Mostovoy, Maxim
  • Nature Materials, Vol. 6, Issue 1
  • DOI: 10.1038/nmat1804

Infrared-Absorption Studies on Barium Titanate and Related Materials
journal, March 1957


Ferroelectric transition in Y Mn O 3 from first principles
journal, September 2005


Hubbard U and Hund exchange J in transition metal oxides: Screening versus localization trends from constrained random phase approximation
journal, October 2012


Influence of magnetic ordering on structural instabilities in insulating perovskites
journal, May 2011

  • Garcia-Fernandez, Pablo; Aramburu, Jose Antonio; Moreno, Miguel
  • Physical Review B, Vol. 83, Issue 17
  • DOI: 10.1103/PhysRevB.83.174406

Origin of giant spin-lattice coupling and the suppression of ferroelectricity in EuTiO 3 from first principles
journal, September 2013


Maximally localized Wannier functions for entangled energy bands
journal, December 2001


Theory of the Role of Covalence in the Perovskite-Type Manganites [ La ,   M ( II ) ] Mn O 3
journal, October 1955


The Lorentz Correction in Barium Titanate
journal, June 1950


Electronic structure calculations of solids using the WIEN2k package for material sciences
journal, August 2002