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Title: Interplay between H 2 O and CO 2 coadsorption and space-charge on Y-doped BaZrO 3 surfaces

Crucial role of coadsorption, surface defects and subsurface space-charge on the surface chemistry of oxides is demonstrated by first-principles calculations.
Authors:
ORCiD logo [1] ; ORCiD logo [2] ;  [3]
  1. SINTEF Industry, Sustainable Energy Technology, NO-0314 Oslo, Norway, Department of Materials Science and Engineering
  2. Department of Materials Science and Engineering, Massachusetts Institute of Technology, Cambridge, USA
  3. Department of Materials Science and Engineering, Massachusetts Institute of Technology, Cambridge, USA, Department of Nuclear Science and Engineering
Publication Date:
Grant/Contract Number:
AC05-00OR22725
Type:
Published Article
Journal Name:
Journal of Materials Chemistry A
Additional Journal Information:
Journal Name: Journal of Materials Chemistry A Journal Volume: 6 Journal Issue: 48; Journal ID: ISSN 2050-7488
Publisher:
Royal Society of Chemistry (RSC)
Sponsoring Org:
USDOE
Country of Publication:
United Kingdom
Language:
English
OSTI Identifier:
1483702

Polfus, Jonathan M., Yang, Jing, and Yildiz, Bilge. Interplay between H 2 O and CO 2 coadsorption and space-charge on Y-doped BaZrO 3 surfaces. United Kingdom: N. p., Web. doi:10.1039/C8TA09491H.
Polfus, Jonathan M., Yang, Jing, & Yildiz, Bilge. Interplay between H 2 O and CO 2 coadsorption and space-charge on Y-doped BaZrO 3 surfaces. United Kingdom. doi:10.1039/C8TA09491H.
Polfus, Jonathan M., Yang, Jing, and Yildiz, Bilge. 2018. "Interplay between H 2 O and CO 2 coadsorption and space-charge on Y-doped BaZrO 3 surfaces". United Kingdom. doi:10.1039/C8TA09491H.
@article{osti_1483702,
title = {Interplay between H 2 O and CO 2 coadsorption and space-charge on Y-doped BaZrO 3 surfaces},
author = {Polfus, Jonathan M. and Yang, Jing and Yildiz, Bilge},
abstractNote = {Crucial role of coadsorption, surface defects and subsurface space-charge on the surface chemistry of oxides is demonstrated by first-principles calculations.},
doi = {10.1039/C8TA09491H},
journal = {Journal of Materials Chemistry A},
number = 48,
volume = 6,
place = {United Kingdom},
year = {2018},
month = {12}
}

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