Recent advances in designing thermoelectric materials

M Mukherjee, A Srivastava, AK Singh - Journal of Materials Chemistry …, 2022 - pubs.rsc.org
The rising demand for energy has accelerated the search for clean and renewable sources
and newer approaches towards efficient energy management. One of the most promising …

Recent progress of two-dimensional heterostructures for thermoelectric applications

PZ Jia, JP Xie, XK Chen, Y Zhang, X Yu… - Journal of Physics …, 2022 - iopscience.iop.org
The rapid development of synthesis and fabrication techniques has opened up a research
upsurge in two-dimensional (2D) material heterostructures, which have received extensive …

Thermoelectric properties of monolayer MSe2 (M= Zr, Hf): low lattice thermal conductivity and a promising figure of merit

G Ding, GY Gao, Z Huang, W Zhang, K Yao - Nanotechnology, 2016 - iopscience.iop.org
Monolayer transition-metal dichalcogenides (TMDCs) MX 2 (M= Mo, W, Zr, Hf, etc; X= S, Se,
Te) have become well-known in recent times for their promising applications in …

Spin orbit coupling induced enhancement of thermoelectric performance of HfX2 (X= S, Se) and its Janus monolayer

J Bera, A Betal, S Sahu - Journal of Alloys and Compounds, 2021 - Elsevier
Rashba spin-orbit coupling (SOC) plays a vital role in transporting carriers under external
electric field or strain in two-dimensional transition metal di-chalcogenides in the absence of …

Mechanical and electronic properties of Janus monolayer transition metal dichalcogenides

W Shi, Z Wang - Journal of Physics: Condensed Matter, 2018 - iopscience.iop.org
The mechanical and electronic properties of Janus monolayer transition metal
dichalcogenides MXY (M= Ti, Zr, Hf, V, Nb, Ta, Cr, Mo, W; X/Y= S, Se, Te) were investigated …

Electronic and thermoelectric properties of transition-metal dichalcogenides

DI Bilc, D Benea, V Pop, P Ghosez… - The Journal of …, 2021 - ACS Publications
Using first-principles electronic structure calculations performed within the B1-WC hybrid
functional, we study the thickness and strain dependency of electronic and thermoelectric …

Screening promising thermoelectric materials in binary chalcogenides through high-throughput computations

T Jia, Z Feng, S Guo, X Zhang… - ACS applied materials & …, 2020 - ACS Publications
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 single …

Engineering of charge carriers via a two-dimensional heterostructure to enhance the thermoelectric figure of merit

G Ding, C Wang, G Gao, K Yao, C Dun, C Feng, D Li… - Nanoscale, 2018 - pubs.rsc.org
High band degeneracy and glassy phonon transport are two remarkable features of highly
efficient thermoelectric (TE) materials. The former promotes the power factor, while the latter …

Raman Spectra of ZrS2 and ZrSe2 from Bulk to Atomically Thin Layers

S Mañas-Valero, V García-López, A Cantarero… - Applied sciences, 2016 - mdpi.com
In the race towards two-dimensional electronic and optoelectronic devices, semiconducting
transition metal dichalcogenides (TMDCs) from group VIB have been intensively studied in …

Strain-induced enhancement of thermoelectric performance of TiS2 monolayer based on first-principles phonon and electron band structures

G Li, K Yao, G Gao - Nanotechnology, 2017 - iopscience.iop.org
Using first-principle calculations combined with Boltzmann transport theory, we investigate
the biaxial strain effect on the electronic and phonon thermal transport properties of a 1 T …