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Self-passivation leads to semiconducting edges of black phosphorene

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Nanoscale Horiz., 2021, 6,148-155
DOI: 10.1039/D0NH00506A, Communication
Li Ping Ding, Feng Ding
Freshly cleaved BPNR edges are reconstructed into highly stable ones dominated by three bond configurations: double PP bonds, P(2)–P(4) with two lone pairs on one P atom and that with all P atoms having three sp3 bonds.
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