Beilstein J. Nanotechnol.2019,10, 2031–2038, doi:10.3762/bjnano.10.199
calculations; molybdenumtrioxides; MoO3 monolayer; oxygen vacancies; thermoelectric properties; Introduction
Thermoelectric materials that can directly convert temperature gradients to voltage gradients and vice versa provide a valid strategy to mitigate the global energy crisis. Owing to the unique ability
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Figure 1:
(a) Crystal structures of the MoO3 monolayer (3 × 3 × 1 supercell): top and side views. (b) The ele...