Thermoelectric properties of Janus MXY (M = Pd, Pt; X, Y = S, Se, Te) transition-metal dichalcogenide monolayers from first principles

In this paper, the thermoelectric (TE) properties of Janus MXY monolayers (M = Pd, Pt; X, Y = S, Se, Te) are systematically studied using first principles and the Boltzmann transport theory. The thermal conductivity (k), Seebeck coefficient (S), power factor (PF), and TE figure of merit (ZT) are cal...

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