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Phosphorene is a single layer of black phosphorous, recently synthesized. blah blah…
Due to the existence of a lone pair of electrons on each P atom, phosphorene can be easily oxidized. At first, we have investigated the structural stability of POx with 0<x<1. For every given 0<x<1 of POx, diverse configurations are considered and optimized to find its equilibrium structure to know whether such a phosphorene oxide can be formed or not.
As x increases in POx, the electronic properties of phosphorene oxides changes. We found an intriguing phenomenon that at around 16% uniaxial tensile strain, PO (with x=1) becomes a metal with a modified Dirac cone at the gamma point in its Brillouin zone.