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A formation mechanism of oxygen vacancies in a MnO2 monolayer: a DFT + U study

Chenghua Sun1, Yong Wang, Jin Zou

  • 1Centre for Computational Molecular Science, Australian Institute of Bioengineering and Nanotechnology, The University of Queensland, QLD 4072, Brisbane, Australia. c.sun1@uq.edu.au

Physical Chemistry Chemical Physics : PCCP
|May 17, 2011
PubMed

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