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Title: Electronic states and magnetic structure at the Co3O4(110) surface: A first-principles study

Authors:
;
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
1099170
Resource Type:
Journal Article: 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: 85 Journal Issue: 8; Journal ID: ISSN 1098-0121
Publisher:
American Physical Society
Country of Publication:
United States
Language:
English

Citation Formats

Chen, Jia, and Selloni, Annabella. Electronic states and magnetic structure at the Co3O4(110) surface: A first-principles study. United States: N. p., 2012. Web. doi:10.1103/PhysRevB.85.085306.
Chen, Jia, & Selloni, Annabella. Electronic states and magnetic structure at the Co3O4(110) surface: A first-principles study. United States. https://doi.org/10.1103/PhysRevB.85.085306
Chen, Jia, and Selloni, Annabella. 2012. "Electronic states and magnetic structure at the Co3O4(110) surface: A first-principles study". United States. https://doi.org/10.1103/PhysRevB.85.085306.
@article{osti_1099170,
title = {Electronic states and magnetic structure at the Co3O4(110) surface: A first-principles study},
author = {Chen, Jia and Selloni, Annabella},
abstractNote = {},
doi = {10.1103/PhysRevB.85.085306},
url = {https://www.osti.gov/biblio/1099170}, journal = {Physical Review. B, Condensed Matter and Materials Physics},
issn = {1098-0121},
number = 8,
volume = 85,
place = {United States},
year = {Mon Feb 13 00:00:00 EST 2012},
month = {Mon Feb 13 00:00:00 EST 2012}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record at https://doi.org/10.1103/PhysRevB.85.085306

Citation Metrics:
Cited by: 101 works
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Works referenced in this record:

Methanol oxidation over model cobalt catalysts: Influence of the cobalt oxidation state on the reactivity
journal, February 2010


Generalized Gradient Approximation Made Simple
journal, October 1996


Nanostructured Cobalt Oxide Clusters in Mesoporous Silica as Efficient Oxygen-Evolving Catalysts
journal, February 2009


Exchange Anisotropy in Nanocasted Co 3 O 4 Nanowires
journal, December 2006


Ferrimagnetic Nanogranular Co 3 O 4 through Solvothermal Decomposition of Colloidally Dispersed Monolayers of α-Cobalt Hydroxide
journal, June 2005


Room-temperature ferromagnetism in the mixtures of the TiO 2 and Co 3 O 4 powders
journal, April 2009


Interface and electronic characterization of thin epitaxial films
journal, January 2009


QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials
journal, September 2009


Supercapacitive cobalt oxide (Co3O4) thin films by spray pyrolysis
journal, August 2006


Intraparticle Magnetic Properties of Co 3 O 4 Nanocrystals
journal, July 2001


Polarity of oxide surfaces and nanostructures
journal, December 2007


Periodic DFT and HR-STEM Studies of Surface Structure and Morphology of Cobalt Spinel Nanocrystals. Retrieving 3D Shapes from 2D Images
journal, March 2011


Prediction of Uncompensated Polarity in Ultrathin Films
journal, May 2007


Electrostatic stability of insulating surfaces: Theory and applications
journal, November 2011


Electric polarization as a bulk quantity and its relation to surface charge
journal, August 1993


Reducibility of Cobalt Species in Silica-Supported Fischer–Tropsch Catalysts
journal, May 1997


Low-temperature oxidation of CO catalysed by Co3O4 nanorods
journal, April 2009


Periodic density functional study of Co3O4 surfaces
journal, January 2011


Surface composition and structure of Co3O4(110) and the effect of impurity segregation
journal, July 2004


Decoupling of magnetic core and shell contributions in antiferromagnetic Co 3 O 4 nanostructures
journal, October 2009


Soft self-consistent pseudopotentials in a generalized eigenvalue formalism
journal, April 1990


Optical investigation of charge-transfer transitions in spinel Co3O4
journal, June 2003


Electronic and Magnetic Properties of SrTiO3/LaAlO3 Interfaces from First Principles
journal, April 2010


The stability of ionic crystal surfaces
journal, November 1979


Stability of Polar Oxide Surfaces
journal, April 2001


Selective Synthesis of Co 3 O 4 Nanocrystal with Different Shape and Crystal Plane Effect on Catalytic Property for Methane Combustion
journal, December 2008


Evidence for surface states in a single 3 nm diameter Co3O4 nanowire
journal, June 2010


Bulk and surface properties of spinel Co3O4 by density functional calculations
journal, February 2009


Insights into Current Limitations of Density Functional Theory
journal, August 2008


Composition, structure, and stability of RuO 2 ( 110 ) as a function of oxygen pressure
journal, December 2001


Electronic structure and bonding properties of cobalt oxide in the spinel structure
journal, June 2011


Linear response approach to the calculation of the effective interaction parameters in the LDA + U method
journal, January 2005


Ab initio molecular dynamics with maximally localized Wannier functions
journal, January 2003