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Coulomb interactions and screening effects in few-layer black phosphorus: a tight-binding consideration beyond the long-wavelength limit

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arxiv 1703.01145 v1 pith:LI6IDWAX submitted 2017-03-03 cond-mat.mtrl-sci cond-mat.mes-hall

Coulomb interactions and screening effects in few-layer black phosphorus: a tight-binding consideration beyond the long-wavelength limit

classification cond-mat.mtrl-sci cond-mat.mes-hall
keywords coulombeffectsfew-layerscreeningbeyondinteractionslimitblack
verification ladder T0 review T1 audit T2 compute T3 formal T4 reserved
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Coulomb interaction and its screening play an important role in many physical phenomena of materials ranging from optical properties to many-body effects including superconductivity. Here, we report on a systematic study of dielectric screening in few-layer black phosphorus (BP), a two-dimensional material with promising electronic and optical characteristics. We use a combination of a tight-binding model and rigorously determined bare Coulomb interactions, which allows us to consider relevant microscopic effects beyond the long-wavelength limit. We calculate the dielectric function of few-layer BP in the random phase approximation and show that it exhibits strongly anisotropic behavior even in the static limit. We also estimate the strength of effective local and non-local Coulomb interactions and determine their doping dependence. We find that the $p_z$ states responsible for low-energy excitations in BP provide a moderate contribution to the screening, weakening the on-site Coulomb interaction by less that a factor of two. Finally, we calculate the full plasmon spectrum of few-layer BP and discuss the effects beyond long-wavelengths.

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