2016
DOI: 10.1039/c5tc03238e
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High thermoelectric performance can be achieved in black phosphorus

Abstract: Few-layer black phosphorus has recently emerged as a promising candidate for novel electronic and optoelectronic device. Here we demonstrate by first-principles calculations and Boltzmann theory that, black phosphorus could also have potential thermoelectric applications and a fair ZT value of 1.1 can be achieved at elevated temperature. Moreover, such value can be further increased to 5.4 by substituting P atom with Sb atom, giving nominal formula of P 0.75 Sb 0.25 . Our theoretical work suggests that high th… Show more

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Cited by 62 publications
(57 citation statements)
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“…28 Similar behaviour was found in a theoretical study of two-dimensional black phosphorous which has an estimated high thermal conductivity leading to low zT. 30 Conversely, some MPs have low experimental thermal conductivity but with high r limiting zT, such as Zintl phases. 31 A lower r was measured for phosphide clathrates, which have also exhibited low thermal conductivities due to rattling mechanisms of the guest atoms.…”
Section: Introductionmentioning
confidence: 53%
“…28 Similar behaviour was found in a theoretical study of two-dimensional black phosphorous which has an estimated high thermal conductivity leading to low zT. 30 Conversely, some MPs have low experimental thermal conductivity but with high r limiting zT, such as Zintl phases. 31 A lower r was measured for phosphide clathrates, which have also exhibited low thermal conductivities due to rattling mechanisms of the guest atoms.…”
Section: Introductionmentioning
confidence: 53%
“…As the most stable allotrope of phosphorus at ambient condition, black phosphorous is a layered material with a direct band gap of 0.3 eV for bulk [109], which, combining its excellent thermal properties, is therefore proposed to be potential candidate for thermoelectric materials [110]. Thermal conductivity measurements were reported by three different groups using confocal micro-Raman method, thermal bridge method and TDTR, respectively [73,[111][112][113].…”
Section: Black Phosphorousmentioning
confidence: 99%
“…11 Theoretically, few-layer BP have been predicted to be a promising thermoelectric material with a high zT when under stress or doping. 12,13 More interestingly, BP is a strongly anisotropic material even in the basal plane: the thermal conductivity is much higher along the zigzag than the armchair direction, while electrical conductivity shows the opposite anisotropy. 14 Choi et al 15 demonstrated that the variable range hopping (VRH) dominates electrical transport in thin BP flakes (10-30 nm thick).…”
mentioning
confidence: 99%