We propose that Dirac cones can be engineered in phosphorene with fourfold-coordinated phosphorus atom. The key is to separate in energy the in-plane (s, px and py) and out-of-plane (pz) oribtals through the sp2 configuration, yielding respective σ- and π-character Dirac cones, and then quench the latter. As a proof-of-principle study, we realize σ-character Dirac cone in hydrogenated/fluorinated phosphorene with the honeycomb lattice. The obtained Dirac cones are at K-points, slightly anisotropic, with Fermi velocities of 0.91/1.23 times that of graphene along ΓK/KM direction, and maintain a good linearity up to ∼2 eV for holes. One substantive advantage of σ-character Dirac cone is its convenience to tune the Dirac gap via in-plane strain. Our findings pave a new way for development of high performance electronic devices based on Dirac materials.
@article{arxiv.1408.6310,
title = {Dirac Fermions in Blue-Phosphorus},
author = {Yuanchang Li and Xiaobin Chen},
journal= {arXiv preprint arXiv:1408.6310},
year = {2014}
}