skip to main content
DOE PAGES title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Electronic structure and orbital polarization of LaNiO3 with a reduced coordination and under strain: A first-principles study

Authors:
;
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
1100849
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
Physical Review. B, Condensed Matter and Materials Physics
Additional Journal Information:
Journal Name: Physical Review. B, Condensed Matter and Materials Physics Journal Volume: 84 Journal Issue: 12; Journal ID: ISSN 1098-0121
Publisher:
American Physical Society
Country of Publication:
United States
Language:
English

Citation Formats

Han, Myung Joon, and van Veenendaal, Michel. Electronic structure and orbital polarization of LaNiO3 with a reduced coordination and under strain: A first-principles study. United States: N. p., 2011. Web. doi:10.1103/PhysRevB.84.125137.
Han, Myung Joon, & van Veenendaal, Michel. Electronic structure and orbital polarization of LaNiO3 with a reduced coordination and under strain: A first-principles study. United States. doi:10.1103/PhysRevB.84.125137.
Han, Myung Joon, and van Veenendaal, Michel. Thu . "Electronic structure and orbital polarization of LaNiO3 with a reduced coordination and under strain: A first-principles study". United States. doi:10.1103/PhysRevB.84.125137.
@article{osti_1100849,
title = {Electronic structure and orbital polarization of LaNiO3 with a reduced coordination and under strain: A first-principles study},
author = {Han, Myung Joon and van Veenendaal, Michel},
abstractNote = {},
doi = {10.1103/PhysRevB.84.125137},
journal = {Physical Review. B, Condensed Matter and Materials Physics},
number = 12,
volume = 84,
place = {United States},
year = {2011},
month = {9}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record
DOI: 10.1103/PhysRevB.84.125137

Citation Metrics:
Cited by: 10 works
Citation information provided by
Web of Science

Save / Share:

Works referenced in this record:

Numerical atomic basis orbitals from H to Kr
journal, May 2004


Dimensionality Control of Electronic Phase Transitions in Nickel-Oxide Superlattices
journal, May 2011


Turning a Nickelate Fermi Surface into a Cupratelike One through Heterostructuring
journal, June 2009


Metal-insulator transitions
journal, October 1998

  • Imada, Masatoshi; Fujimori, Atsushi; Tokura, Yoshinori
  • Reviews of Modern Physics, Vol. 70, Issue 4, p. 1039-1263
  • DOI: 10.1103/RevModPhys.70.1039

Optical conductivity of LaNiO 3 : Coherent transport and correlation driven mass enhancement
journal, October 2010


Variationally optimized basis orbitals for biological molecules
journal, January 2004

  • Ozaki, T.; Kino, H.
  • The Journal of Chemical Physics, Vol. 121, Issue 22
  • DOI: 10.1063/1.1794591

Quantifying octahedral rotations in strained perovskite oxide films
journal, July 2010


Electric-Field Control of the Metal-Insulator Transition in Ultrathin NdNiO3 Films
journal, October 2010

  • Scherwitzl, Raoul; Zubko, Pavlo; Lezama, I. Gutierrez
  • Advanced Materials, Vol. 22, Issue 48
  • DOI: 10.1002/adma.201003241

Two-Dimensional Electron Gases at Oxide Interfaces
journal, November 2008

  • Mannhart, J.; Blank, D. H. A.; Hwang, H. Y.
  • MRS Bulletin, Vol. 33, Issue 11
  • DOI: 10.1557/mrs2008.222

Variationally optimized atomic orbitals for large-scale electronic structures
journal, April 2003


Room-temperature magnetism in LaVO 3 / SrVO 3 superlattices by geometrically confined doping
journal, December 2009


Systematic study of insulator-metal transitions in perovskites RNiO3 (R=Pr,Nd,Sm,Eu) due to closing of charge-transfer gap
journal, April 1992


Ground State of the Electron Gas by a Stochastic Method
journal, August 1980


Superconducting Interfaces Between Insulating Oxides
journal, August 2007


Orbital Reconstruction and Covalent Bonding at an Oxide Interface
journal, November 2007


Quantum confinement of Mott electrons in ultrathin LaNiO 3 /LaAlO 3 superlattices
journal, April 2011


Conductivity enhancement of ultrathin LaNiO3 films in superlattices
journal, November 2010

  • Son, Junwoo; LeBeau, James M.; Allen, S. James
  • Applied Physics Letters, Vol. 97, Issue 20
  • DOI: 10.1063/1.3511738

Artificial charge-modulationin atomic-scale perovskite titanate superlattices
journal, September 2002

  • Ohtomo, A.; Muller, D. A.; Grazul, J. L.
  • Nature, Vol. 419, Issue 6905
  • DOI: 10.1038/nature00977

Onset of metallic behavior in strained ( LaNiO 3 ) n / ( SrMnO 3 ) 2 superlattices
journal, March 2009


Strain-mediated metal-insulator transition in epitaxial ultrathin films of NdNiO3
journal, June 2010

  • Liu, Jian; Kareev, M.; Gray, B.
  • Applied Physics Letters, Vol. 96, Issue 23
  • DOI: 10.1063/1.3451462

Optical study of strained ultrathin films of strongly correlated LaNiO 3
journal, February 2011


Electronic reconstruction at an interface between a Mott insulator and a band insulator
journal, April 2004


Efficient pseudopotentials for plane-wave calculations
journal, January 1991