Abstract
We investigate the edge bands of the relaxed phosphorene edges. The edge relaxation is modeled by letting the outmost bonds be different. By treating the relaxed hopping energy as a parameter, we observe the phase transition for the edge band appearance in the bulk gap. The analytical expression of the relaxed hopping for the phase transition is obtained by means of tight-binding parameters.
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Yang, M., Duan, HJ. & Wang, RQ. Phase transition for edge band emergence induced by the edge relaxation of phosphorene ribbons. Jetp Lett. 102, 290–294 (2015). https://doi.org/10.1134/S0021364015170130
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DOI: https://doi.org/10.1134/S0021364015170130