skip to main content

DOE PAGESDOE PAGES

Title: Fine-Tuning the Properties of Doped Multifunctional Materials by Controlled Reduction of Dopants

Authors:
 [1] ;  [1] ;  [1] ;  [1] ;  [1] ;  [2] ;  [2] ;  [1] ;  [1]
  1. Institut des Matériaux Jean Rouxel (IMN), Université de Nantes, CNRS, 2 rue de la Houssinière 44322 Nantes Cedex 3 France
  2. Department of Chemistry, North Carolina State University, Raleigh NC 27695-8204 USA
Publication Date:
Grant/Contract Number:
AC02-05CH11231
Type:
Publisher's Accepted Manuscript
Journal Name:
Chemistry - A European Journal
Additional Journal Information:
Journal Name: Chemistry - A European Journal Journal Volume: 23 Journal Issue: 13; Journal ID: ISSN 0947-6539
Publisher:
Wiley Blackwell (John Wiley & Sons)
Sponsoring Org:
USDOE
Country of Publication:
Germany
Language:
English
OSTI Identifier:
1400466

Barroux, Hugo, Jiang, Tengfei, Paul, Camille, Massuyeau, Florian, Génois, Romain, Gordon, Elijah E., Whangbo, Myung-Hwan, Jobic, Stéphane, and Gautier, Romain. Fine-Tuning the Properties of Doped Multifunctional Materials by Controlled Reduction of Dopants. Germany: N. p., Web. doi:10.1002/chem.201605707.
Barroux, Hugo, Jiang, Tengfei, Paul, Camille, Massuyeau, Florian, Génois, Romain, Gordon, Elijah E., Whangbo, Myung-Hwan, Jobic, Stéphane, & Gautier, Romain. Fine-Tuning the Properties of Doped Multifunctional Materials by Controlled Reduction of Dopants. Germany. doi:10.1002/chem.201605707.
Barroux, Hugo, Jiang, Tengfei, Paul, Camille, Massuyeau, Florian, Génois, Romain, Gordon, Elijah E., Whangbo, Myung-Hwan, Jobic, Stéphane, and Gautier, Romain. 2017. "Fine-Tuning the Properties of Doped Multifunctional Materials by Controlled Reduction of Dopants". Germany. doi:10.1002/chem.201605707.
@article{osti_1400466,
title = {Fine-Tuning the Properties of Doped Multifunctional Materials by Controlled Reduction of Dopants},
author = {Barroux, Hugo and Jiang, Tengfei and Paul, Camille and Massuyeau, Florian and Génois, Romain and Gordon, Elijah E. and Whangbo, Myung-Hwan and Jobic, Stéphane and Gautier, Romain},
abstractNote = {},
doi = {10.1002/chem.201605707},
journal = {Chemistry - A European Journal},
number = 13,
volume = 23,
place = {Germany},
year = {2017},
month = {2}
}

Works referenced in this record:

Generalized Gradient Approximation Made Simple
journal, October 1996
  • Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias
  • Physical Review Letters, Vol. 77, Issue 18, p. 3865-3868
  • DOI: 10.1103/PhysRevLett.77.3865

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
journal, July 1996

Infinite-layer iron oxide with a square-planar coordination
journal, December 2007
  • Tsujimoto, Y.; Tassel, C.; Hayashi, N.
  • Nature, Vol. 450, Issue 7172, p. 1062-1065
  • DOI: 10.1038/nature06382

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

Ab initiomolecular dynamics for liquid metals
journal, January 1993