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W2051984976 abstract "The thermoelectric compound TiS2 is studied by using the full-potential linearized augmented plane-wave method on the density functional theory with the generalized gradient approximation (GGA) as well as the on-site Coulomb interaction correction (+U). The Seebeck coefficient of TiS2 is calculated based on the electronic structure obtained within the GGA under the consideration of the on-site Coulomb interaction. The calculated Seebeck coefficient at 300 K shows that Coulomb interaction U in the range of 4.97–5.42 eV is important to reproduce the experimental data. The obtained energy gap Eg around 0.05 eV indicates that TiS2 is an indirect narrow-gap semiconductor." @default.
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W2051984976 date "2007-04-01" @default.
W2051984976 modified "2023-09-23" @default.
W2051984976 title "Strongly Correlated Effect in TiS <sub>2</sub>" @default.
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W2051984976 doi "https://doi.org/10.1088/0256-307x/24/4/056" @default.
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