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• W4205126237 abstract "We investigate the electrical and thermal transport coefficients of an emergent transition metal tri-chalcogenide, namely, ${mathrm{TiS}}_{3}$. We implement an accurate description of the electron-phonon coupling and thus of the energy dependence of the relaxation time, which goes beyond the commonly used approximations. We find that standard calculation methods fail in accurately describing the thermoelectric transport properties of ${mathrm{TiS}}_{3}$ and one needs to go beyond standard approximations to correctly investigate the thermoelectric performance of ${mathrm{TiS}}_{3}$ and other 2D materials. By applying state-of-the-art ab initio methods, we conclude that ${mathrm{TiS}}_{3}$ stands as a potential candidate for thermoelectric applications." @default.
• W4205126237 created "2022-01-26" @default.
• W4205126237 creator A5052713796 @default.
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• W4205126237 date "2022-01-21" @default.
• W4205126237 modified "2023-09-24" @default.
• W4205126237 title "Transport coefficients of layered <mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML><mml:msub><mml:mrow><mml:mi>TiS</mml:mi></mml:mrow><mml:mn>3</mml:mn></mml:msub></mml:math>" @default.
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• W4205126237 doi "https://doi.org/10.1103/physrevmaterials.6.014004" @default.
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