Computational investigation of defect segregation at the (001) surface of BaCeO3 and BaZrO3: the role of metal–oxygen bond strength in controlling vacancy segregation
Abstract
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* Corresponding authors
a
Department of Chemical and Biological Engineering, University of Colorado Boulder, Campus Box 596, Boulder, Colorado, USA
E-mail:
Will.Medlin@colorado.edu
Tel: +1-303-492-2418
b Department of Metallurgical and Materials Engineering, Colorado School of Mines, Golden, Colorado, USA
c Renewable Energy Materials Research Science and Engineering Center, Colorado School of Mines, Golden, Colorado, USA
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T. Tauer, R. O'Hayre and J. W. Medlin, J. Mater. Chem. A, 2013, 1, 2840 DOI: 10.1039/C2TA01297A
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