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Phys Rev Lett. 2017 Jun 30;118(26):266401. doi: 10.1103/PhysRevLett.118.266401. Epub 2017 Jun 27.

Scaling Universality between Band Gap and Exciton Binding Energy of Two-Dimensional Semiconductors.

Author information

1
State Key Laboratory of Low-Dimensional Quantum Physics and Collaborative Innovation Center of Quantum Matter, Department of Physics, Tsinghua University, Beijing 100084, China.
2
College of Chemistry and Molecular Engineering, Peking University, Beijing 100871, China.
3
CAS Center for Excellence in Nanoscience, National Center for Nanoscience and Technology, Beijing 100190, China.
4
Institute for Advanced Study, Tsinghua University, Beijing 100084, China.

Abstract

Using first-principles   GW Bethe-Salpeter equation calculations and the k·p theory, we unambiguously show that for two-dimensional (2D) semiconductors, there exists a robust linear scaling law between the quasiparticle band gap (E_{g}) and the exciton binding energy (E_{b}), namely, E_{b}≈E_{g}/4, regardless of their lattice configuration, bonding characteristic, as well as the topological property. Such a parameter-free universality is never observed in their three-dimensional counterparts. By deriving a simple expression for the 2D polarizability merely with respect to E_{g}, and adopting the screened hydrogen model for E_{b}, the linear scaling law can be deduced analytically. This work provides an opportunity to better understand the fantastic consequence of the 2D nature for materials, and thus offers valuable guidance for their property modulation and performance control.

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