Thermal expansion tensors, Grüneisen parameters and phonon velocities of bulk MT2 (M = W and Mo; T = S and Se) from first principles calculations
Author:
Affiliation:
1. College of Optoelectronics Technology
2. Chengdu University of Information Technology
3. Chengdu
4. People's Republic of China
5. Department of Earth Sciences
6. University College London
7. London
8. UK
Abstract
The thermal properties of 2H-MT2 (M = W/Mo, T = S/Se) structures are calculated using the quasi-harmonic approximation based on phonon spectra.
Publisher
Royal Society of Chemistry (RSC)
Subject
General Chemical Engineering,General Chemistry
Link
http://pubs.rsc.org/en/content/articlepdf/2015/RA/C4RA16966B
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4. WS2 As an Excellent High-Temperature Thermoelectric Material
5. Frictional Characteristics of Atomically Thin Sheets
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