4 citations · 6 across the 4 of their papers we have counts for
5 papers
First-principles study of the effects of electron-phonon coupling on the thermoelectric properties: a case study of SiGe compound
D. D. Fan, H. J. Liu, L. Cheng +2
It is generally assumed in the thermoelectric community that the lattice thermal conductivity of a given material is independent of the electronic properties. This perspective is h…
First-principles study of the thermoelectric properties of Zintl compound KSnSb
S. Huang, H. J. Liu, D. D. Fan +4
The unique structure of Zintl phase makes it an ideal system to realize the concept of phonon-glass and electron-crystal in the thermoelectric community. In this work, by combining…
Large scale calculations of thermoelectric transport coefficients: a case study of γ-graphyne with point defects
Jinghua Liang, Huijun Liu, Dengdong Fan +1
Defects such as vacancies and impurities could have profound effects on the transport properties of thermoelectric materials. However, it is usually quite difficult to directly cal…
Predicting the optimized thermoelectric performance of MgAgSb
C. Y. Sheng, H. J. Liu, D. D. Fan +5
Using first-principles method and Boltzmann theory, we provide an accurate prediction of the electronic band structure and thermoelectric transport properties of alpha-MgAgSb. Our…
Graphdiyne: a two-dimensional thermoelectric material with high figure of merit
L. Sun, P. H. Jiang, H. J. Liu +6
As a new carbon allotrope, the recently fabricated graphdiyne has attracted much attention due to its interesting two-dimensional character. Here we demonstrate by multiscale compu…