Synthesis and Transport Properties of the Family of Zintl Phases Ca3RESb3 (RE = La–Nd, Sm, Gd–Tm, Lu): Exploring the Roles of Crystallographic Disorder and Core 4f Electrons for Enhancing Thermoelectric Performance

Author(s):  
Michael O. Ogunbunmi ◽  
Sviatoslav Baranets ◽  
Svilen Bobev
2021 ◽  
Vol 860 ◽  
pp. 158355
Author(s):  
Taras Parashchuk ◽  
Ihor Horichok ◽  
Artur Kosonowski ◽  
Oleksandr Cherniushok ◽  
Piotr Wyzga ◽  
...  

2021 ◽  
Author(s):  
H. R. Mahida ◽  
Deobrat Singh ◽  
Yogesh Sonvane ◽  
Sanjeev K. Gupta ◽  
P. B. Thakor ◽  
...  

In the present study, we have investigated the structural, electronic, and charge transport properties of pristine, hydrogenated, and oxidized Si2BN monolayers via first-principles calculations based on density functional theory (DFT).


2019 ◽  
Vol 7 (3) ◽  
pp. 1045-1054 ◽  
Author(s):  
Hasbuna Kamila ◽  
Prashant Sahu ◽  
Aryan Sankhla ◽  
Mohammad Yasseri ◽  
Hoang-Ngan Pham ◽  
...  

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


2012 ◽  
Vol 60 (4) ◽  
pp. 1741-1746 ◽  
Author(s):  
Wen-Yu Zhao ◽  
Zhu Liang ◽  
Ping Wei ◽  
Jian Yu ◽  
Qing-Jie Zhang ◽  
...  

2001 ◽  
Vol 691 ◽  
Author(s):  
David J. Singh

ABSTRACTThis paper reviews the connections between the transport properties underlying the thermoelectric performance of a material and microscopic quantities, particularly as they may be obtained from first principles calculations. These are illustrated using examples from work on skutterudites. The results are used to suggest yet to be explored avenues for achieving higher thermoelectric performance within this class of materials.


2010 ◽  
Vol 22 (3) ◽  
pp. 935-941 ◽  
Author(s):  
Tanghong Yi ◽  
Catherine A. Cox ◽  
Eric S. Toberer ◽  
G. Jeffrey Snyder ◽  
Susan M. Kauzlarich

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