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cond-mat.mtrl-sci2019★ 32 cited
Excellent Thermoelectric Performances of Pressure Synthesized ZnSe2
Tiantian Jia, Jesus Carrete, Zhenzhen Feng +3
We calculate the lattice thermal conductivities of the pyrite-type ZnSe2 at pressures of 0 and 10 GPa using the linearized phonon Boltzmann transport equation. We obtain a very low…
cond-mat.mtrl-sci2019
Screening Promising Thermoelectric Materials in Binary Chalcogenides through High-Throughput Computations
Tiantian Jia, Zhenzhen Feng, Shuping Guo +2
The high-throughput (HT) computational method is a useful tool to screen high performance functional materials. In this work, using the deformation potential method under the singl…