High thermoelectric performance in Te-free (Bi,Sb)2Se3via structural transition induced band convergence and chemical bond softening

2016 ◽  
Vol 9 (11) ◽  
pp. 3436-3447 ◽  
Author(s):  
Shanyu Wang ◽  
Yongxing Sun ◽  
Jiong Yang ◽  
Bo Duan ◽  
Lihua Wu ◽  
...  
Keyword(s):  
Chemical Bond ◽  
Structural Transition ◽  
Phonon Scattering ◽  
Thermoelectric Performance ◽  
Electronic Band ◽  
Bond Softening

In Te-free (Bi,Sb)2Se3, structural transition induced electronic band convergence and intensified phonon scattering triple the thermoelectric ZT to 1.0.

scholarly journals Enhanced thermoelectric performance in Sb–Br codoped Bi2Se3 with complex electronic structure and chemical bond softening

RSC Advances ◽  
2022 ◽  
Vol 12 (3) ◽  
pp. 1653-1662
Author(s):  
Ju Zhang ◽  
Shiqi Zhong ◽  
San-Huang Ke
Keyword(s):  
Electronic Structure ◽  
Charge Density ◽  
Chemical Bond ◽  
Density Difference ◽  
Thermoelectric Performance ◽  
Charge Density Difference ◽  
Bond Softening

A detailed description of the charge density difference of BiSb(Se0.92Br0.08)3.

Enhancement of the thermoelectric performance of bulk SnTe alloys via the synergistic effect of band structure modification and chemical bond softening

2017 ◽  
Vol 5 (27) ◽  
pp. 14165-14173 ◽  
Author(s):  
Hongchao Wang ◽  
Junphil Hwang ◽  
Chao Zhang ◽  
Teng Wang ◽  
Wenbin Su ◽  
...  
Keyword(s):  
Synergistic Effect ◽  
Band Structure ◽  
Seebeck Coefficient ◽  
Effective Mass ◽  
Chemical Bond ◽  
Resonance Level ◽  
Thermoelectric Performance ◽  
Energy Separation ◽  
Structure Modification ◽  
Bond Softening

Seebeck coefficient of SnTe is largely enhanced by large band effective mass or decrease of energy separation through synergistic effect including resonance level and band convergence.

High Thermoelectric Performance of ZnO by Coherent Phonon Scattering and Optimized Charge Transport

2021 ◽  
pp. 2105008
Author(s):  
Somnath Acharya ◽  
Byung‐Kyu Yu ◽  
Junphil Hwang ◽  
Jiyong Kim ◽  
Woochul Kim
Keyword(s):  
Charge Transport ◽  
Phonon Scattering ◽  
Thermoelectric Performance ◽  
Coherent Phonon

scholarly journals First-principles predictions of low lattice thermal conductivity and high thermoelectric performance of AZnSb (A = Rb, Cs)

RSC Advances ◽  
2021 ◽  
Vol 11 (25) ◽  
pp. 15486-15496
Author(s):  
Enamul Haque
Keyword(s):  
Thermal Conductivity ◽  
Debye Temperature ◽  
Layered Structure ◽  
First Principles ◽  
Lattice Thermal Conductivity ◽  
Phonon Scattering ◽  
Thermoelectric Performance

The layered structure, and presence of heavier elements Rb/Cs and Sb induce high anharmonicity, low Debye temperature, intense phonon scattering, and hence, low lattice thermal conductivity.

scholarly journals Metal phosphides as potential thermoelectric materials

2017 ◽  
Vol 5 (47) ◽  
pp. 12441-12456 ◽  
Author(s):  
Jan-Hendrik Pöhls ◽  
Alireza Faghaninia ◽  
Guido Petretto ◽  
Umut Aydemir ◽  
Francesco Ricci ◽  
...  
Keyword(s):  
Thermoelectric Materials ◽  
Thermoelectric Performance ◽  
Band Structures ◽  
Electronic Band ◽  
Metal Phosphides ◽  
Electronic Band Structures ◽  
Thermal Conductivities

Metal phosphides are predicted to have high thermoelectric performance due to enhanced electronic band structures and low thermal conductivities.

scholarly journals Analyzing transport properties of p-type Mg2Si–Mg2Sn solid solutions: optimization of thermoelectric performance and insight into the electronic band structure

2019 ◽  
Vol 7 (3) ◽  
pp. 1045-1054 ◽  
Author(s):  
Hasbuna Kamila ◽  
Prashant Sahu ◽  
Aryan Sankhla ◽  
Mohammad Yasseri ◽  
Hoang-Ngan Pham ◽  
...  
Keyword(s):  
Band Structure ◽  
Transport Properties ◽  
Carrier Concentration ◽  
Solid Solutions ◽  
Figure Of Merit ◽  
Electronic Band Structure ◽  
Thermoelectric Performance ◽  
Electronic Band ◽  
P Type ◽  
Insight Into

Figure of merit zT mapping of p-Mg2Si1−xSnx with respect to carrier concentration.

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