Publications with the keyword "lattice relaxation"

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G. Otero, P. Lustemberg, F. Prado, and M. Ganduglia-Pirovano
Relative Stability of Near-Surface Oxygen Vacancies at the CeO2(111) Surface upon Zirconium Doping
Journal of Physical Chemistry C (cited By 0), 2019
cerium oxide density functional theory stability zirconium dopant concentrations formation energies lattice relaxation nearest neighbors relative stabilities stable configuration stable structures surface oxygen vacancies oxygen vacancies
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