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Published in 2017 at "Nanoscale"
DOI: 10.1039/c6nr08810d
Abstract: Combining the screening by first-principles calculations and Born-Oppenheimer molecular dynamics simulations, we fully reconsider phosphorene oxidation and the formation of low-dimensional phosphorus oxides (PxOy). It is found that the previously reported 2-dimensional PxOy (2d-PxOy) structures…
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Keywords:
pxoy structures;
pxoy;
properties phosphorene;
phosphorene oxides ... See more keywords