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• W2891773883 abstract "We study the electronic transport coefficients and the thermoelectric figure of merit ZT in -doped Mg3Sb2 based on density-functional electronic structure and Bloch–Boltzmann transport theory with an energy- and temperature-dependent relaxation time. Both the lattice and electronic thermal conductivities affect the final ZT significantly, hence we include the lattice thermal conductivity calculated ab initio. Where applicable, our results are in good agreement with existing experiments, thanks to the treatment of lattice thermal conductivity and the improved description of electronic scattering. ZT increases monotonically in our range (300–700 K), reaching a value of 1.6 at 700 K; it peaks as a function of doping at about cm−3. At this doping, ZT 1 for K." @default.
• W2891773883 created "2018-09-27" @default.
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• W2891773883 date "2018-12-24" @default.
• W2891773883 modified "2023-09-26" @default.
• W2891773883 title "Theory of thermoelectricity in Mg₃Sb₂ with an energy- and temperature-dependent relaxation time" @default.
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• W2891773883 doi "https://doi.org/10.1088/1361-648x/aaf364" @default.
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