准粒子
激子
单层
亚稳态
GW近似
结合能
材料科学
半导体
硫化物
群(周期表)
凝聚态物理
物理
分子物理学
原子物理学
纳米技术
光电子学
量子力学
超导电性
冶金
作者
Blair Tuttle,Saeed M. Alhassan,Sokrates T. Pantelides
标识
DOI:10.1103/physrevb.92.235405
摘要
Large exciton binding energies are a distinguishing feature of two-dimensional semiconductors because of reduced screening, potentially leading to unique optoelectronic applications. Here we use electronic structure methods to calculate the properties of a two-dimensional material class: group-IV monosulfides including SiS, GeS, and SnS. Bulk SiS is predicted to be a metastable layered material. Quasiparticle excitations are calculated with the ${G}_{0}{W}_{0}$ method and the Bethe-Salpeter equation is are used to include electron-hole interactions. For monolayers, strongly bound excitons are found below the quasiparticle absorption edge. The predicted excitonic binding energies are as high as 0.7 eV. Due to large excitonic effects, these group-IV sulfide monolayers have great potential for nanoscale optoelectronic applications.
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