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

Title: A full monolayer of superoxide: oxygen activation on the unmodified Ca 3 Ru 2 O 7 (001) surface

Abstract

Ca 3 Ru 2 O 7 (001), an oxide surface without dopants, defects, or low-coordinated sites, readily activates molecular oxygen to O 2 .

Authors:
ORCiD logo [1];  [2];  [1]; ORCiD logo [3];  [3];  [3];  [1]; ORCiD logo [2];  [2]; ORCiD logo [1]
  1. Institute of Applied Physics, TU Wien, 1040 Vienna, Austria
  2. Institute of Applied Physics, TU Wien, 1040 Vienna, Austria, Center for Computational Materials Science
  3. Department of Physics and Engineering Physics, Tulane University, New Orleans, USA
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
1425710
Grant/Contract Number:  
SC0012432
Resource Type:
Journal Article: Published Article
Journal Name:
Journal of Materials Chemistry A
Additional Journal Information:
Journal Name: Journal of Materials Chemistry A Journal Volume: 6 Journal Issue: 14; Journal ID: ISSN 2050-7488
Publisher:
Royal Society of Chemistry (RSC)
Country of Publication:
United Kingdom
Language:
English

Citation Formats

Halwidl, Daniel, Mayr-Schmölzer, Wernfried, Setvin, Martin, Fobes, David, Peng, Jin, Mao, Zhiqiang, Schmid, Michael, Mittendorfer, Florian, Redinger, Josef, and Diebold, Ulrike. A full monolayer of superoxide: oxygen activation on the unmodified Ca 3 Ru 2 O 7 (001) surface. United Kingdom: N. p., 2018. Web. doi:10.1039/C8TA00265G.
Halwidl, Daniel, Mayr-Schmölzer, Wernfried, Setvin, Martin, Fobes, David, Peng, Jin, Mao, Zhiqiang, Schmid, Michael, Mittendorfer, Florian, Redinger, Josef, & Diebold, Ulrike. A full monolayer of superoxide: oxygen activation on the unmodified Ca 3 Ru 2 O 7 (001) surface. United Kingdom. doi:10.1039/C8TA00265G.
Halwidl, Daniel, Mayr-Schmölzer, Wernfried, Setvin, Martin, Fobes, David, Peng, Jin, Mao, Zhiqiang, Schmid, Michael, Mittendorfer, Florian, Redinger, Josef, and Diebold, Ulrike. Mon . "A full monolayer of superoxide: oxygen activation on the unmodified Ca 3 Ru 2 O 7 (001) surface". United Kingdom. doi:10.1039/C8TA00265G.
@article{osti_1425710,
title = {A full monolayer of superoxide: oxygen activation on the unmodified Ca 3 Ru 2 O 7 (001) surface},
author = {Halwidl, Daniel and Mayr-Schmölzer, Wernfried and Setvin, Martin and Fobes, David and Peng, Jin and Mao, Zhiqiang and Schmid, Michael and Mittendorfer, Florian and Redinger, Josef and Diebold, Ulrike},
abstractNote = {Ca 3 Ru 2 O 7 (001), an oxide surface without dopants, defects, or low-coordinated sites, readily activates molecular oxygen to O 2 − .},
doi = {10.1039/C8TA00265G},
journal = {Journal of Materials Chemistry A},
number = 14,
volume = 6,
place = {United Kingdom},
year = {Mon Jan 01 00:00:00 EST 2018},
month = {Mon Jan 01 00:00:00 EST 2018}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record at 10.1039/C8TA00265G

Save / Share:

Works referenced in this record:

From ultrasoft pseudopotentials to the projector augmented-wave method
journal, January 1999


Electron-energy-loss spectra and the structural stability of nickel oxide: An LSDA+U study
journal, January 1998

  • Dudarev, S. L.; Botton, G. A.; Savrasov, S. Y.
  • Physical Review B, Vol. 57, Issue 3, p. 1505-1509
  • DOI: 10.1103/PhysRevB.57.1505