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Title: Optimizing the thermoelectric performance of low-temperature SnSe compounds by electronic structure design

Abstract

Figure-of-merit factorZTdepending on hope-carrier density for single and polycrystal SnSe compounds atT= 675 K.

Authors:
 [1];  [1];  [1];  [1];  [1];  [2]
  1. Laboratory of Solid State Microstructures and Innovation Center of Advanced Microstructures; Nanjing University; Nanjing 210093; China
  2. Department of Physics and TcSUH; University of Houston; Houston; USA
Publication Date:
Research Org.:
Energy Frontier Research Centers (EFRC) (United States). Solid-State Solar-Thermal Energy Conversion Center (S3TEC)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1387057
DOE Contract Number:  
SC0001299; FG02-09ER46577
Resource Type:
Journal Article
Journal Name:
Journal of Materials Chemistry. A
Additional Journal Information:
Journal Volume: 3; Journal Issue: 25; Related Information: S3TEC partners with Massachusetts Institute of Technology (lead); Boston College; Oak Ridge National Laboratory; Rensselaer Polytechnic Institute; Journal ID: ISSN 2050-7488
Publisher:
Royal Society of Chemistry
Country of Publication:
United States
Language:
English
Subject:
solar (photovoltaic), solar (thermal), solid state lighting, phonons, thermal conductivity, thermoelectric, defects, mechanical behavior, charge transport, spin dynamics, materials and chemistry by design, optics, synthesis (novel materials), synthesis (self-assembly), synthesis (scalable processing)

Citation Formats

Hong, A. J., Li, L., Zhu, H. X., Yan, Z. B., Liu, J. -M., and Ren, Z. F. Optimizing the thermoelectric performance of low-temperature SnSe compounds by electronic structure design. United States: N. p., 2015. Web. doi:10.1039/c5ta01703c.
Hong, A. J., Li, L., Zhu, H. X., Yan, Z. B., Liu, J. -M., & Ren, Z. F. Optimizing the thermoelectric performance of low-temperature SnSe compounds by electronic structure design. United States. doi:10.1039/c5ta01703c.
Hong, A. J., Li, L., Zhu, H. X., Yan, Z. B., Liu, J. -M., and Ren, Z. F. Thu . "Optimizing the thermoelectric performance of low-temperature SnSe compounds by electronic structure design". United States. doi:10.1039/c5ta01703c.
@article{osti_1387057,
title = {Optimizing the thermoelectric performance of low-temperature SnSe compounds by electronic structure design},
author = {Hong, A. J. and Li, L. and Zhu, H. X. and Yan, Z. B. and Liu, J. -M. and Ren, Z. F.},
abstractNote = {Figure-of-merit factorZTdepending on hope-carrier density for single and polycrystal SnSe compounds atT= 675 K.},
doi = {10.1039/c5ta01703c},
journal = {Journal of Materials Chemistry. A},
issn = {2050-7488},
number = 25,
volume = 3,
place = {United States},
year = {2015},
month = {1}
}

Works referenced in this record:

Generalized Gradient Approximation Made Simple
journal, October 1996

  • Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias
  • Physical Review Letters, Vol. 77, Issue 18, p. 3865-3868
  • DOI: 10.1103/PhysRevLett.77.3865

Hall coefficient of cubic metals
journal, May 1992


Crystal structure, electronic structure, and thermoelectric properties of Ca5Al2Sb6
journal, January 2011

  • Yan, Yu Li; Wang, Yuan Xu
  • Journal of Materials Chemistry, Vol. 21, Issue 33
  • DOI: 10.1039/c1jm11463h

Electronic structure and thermoelectric properties of Sb-based semiconducting half-Heusler compounds
journal, February 2011


Outstanding thermoelectric performances for both p- and n-type SnSe from first-principles study
journal, September 2015


Thermoelectric properties of AgGaTe 2 and related chalcopyrite structure materials
journal, March 2012


Complex thermoelectric materials
journal, February 2008

  • Snyder, G. Jeffrey; Toberer, Eric S.
  • Nature Materials, Vol. 7, Issue 2, p. 105-114
  • DOI: 10.1038/nmat2090

When thermoelectrics reached the nanoscale
journal, June 2013

  • Heremans, Joseph P.; Dresselhaus, Mildred S.; Bell, Lon E.
  • Nature Nanotechnology, Vol. 8, Issue 7
  • DOI: 10.1038/nnano.2013.129

Analysis of the thermoelectric properties of n -type ZnO
journal, March 2011


New Directions for Low-Dimensional Thermoelectric Materials
journal, April 2007

  • Dresselhaus, M. S.; Chen, G.; Tang, M. Y.
  • Advanced Materials, Vol. 19, Issue 8, p. 1043-1053
  • DOI: 10.1002/adma.200600527

Thermoelectric properties of chalcopyrite type CuGaTe 2 and chalcostibite CuSbS 2
journal, December 2013

  • Kumar Gudelli, Vijay; Kanchana, V.; Vaitheeswaran, G.
  • Journal of Applied Physics, Vol. 114, Issue 22
  • DOI: 10.1063/1.4842095

SnSe Nanocrystals: Synthesis, Structure, Optical Properties, and Surface Chemistry
journal, July 2010

  • Baumgardner, William J.; Choi, Joshua J.; Lim, Yee-Fun
  • Journal of the American Chemical Society, Vol. 132, Issue 28, p. 9519-9521
  • DOI: 10.1021/ja1013745

Transport coefficients from first-principles calculations
journal, September 2003


Enhancement of Thermoelectric Efficiency in PbTe by Distortion of the Electronic Density of States
journal, July 2008

  • Heremans, J. P.; Jovovic, V.; Toberer, E. S.
  • Science, Vol. 321, Issue 5888, p. 554-557
  • DOI: 10.1126/science.1159725

High thermoelectric performance in n-type BiAgSeS due to intrinsically low thermal conductivity
journal, January 2013

  • Pei, Yan-Ling; Wu, Haijun; Sui, Jiehe
  • Energy & Environmental Science, Vol. 6, Issue 6
  • DOI: 10.1039/c3ee40879e

Thermoelectric Materials, Phenomena, and Applications: A Bird's Eye View
journal, March 2006

  • Tritt, Terry M.; Subramanian, M. A.
  • MRS Bulletin, Vol. 31, Issue 3
  • DOI: 10.1557/mrs2006.44

Extremely high electron mobility in a phonon-glass semimetal
journal, April 2013

  • Ishiwata, S.; Shiomi, Y.; Lee, J. S.
  • Nature Materials, Vol. 12, Issue 6
  • DOI: 10.1038/nmat3621

Anomalous transport and thermoelectric performances of CuAgSe compounds
journal, August 2014


Influence of band structure on the large thermoelectric performance of lanthanum telluride
journal, April 2009


BoltzTraP. A code for calculating band-structure dependent quantities
journal, July 2006


Ultralow thermal conductivity and high thermoelectric figure of merit in SnSe crystals
journal, April 2014

  • Zhao, Li-Dong; Lo, Shih-Han; Zhang, Yongsheng
  • Nature, Vol. 508, Issue 7496, p. 373-377
  • DOI: 10.1038/nature13184

Neutron diffraction study of the structural phase transition in SnS and SnSe
journal, January 1986

  • Chattopadhyay, T.; Pannetier, J.; Von Schnering, H. G.
  • Journal of Physics and Chemistry of Solids, Vol. 47, Issue 9, p. 879-885
  • DOI: 10.1016/0022-3697(86)90059-4

Calculated thermoelectric properties of La-filled skutterudites
journal, July 1997


Electronic structures and thermoelectric properties of layered BiCuOCh oxychalcogenides (Ch = S, Se and Te): first-principles calculations
journal, January 2013

  • Zou, Daifeng; Xie, Shuhong; Liu, Yunya
  • Journal of Materials Chemistry A, Vol. 1, Issue 31
  • DOI: 10.1039/c3ta11222e

High-Thermoelectric Performance of Nanostructured Bismuth Antimony Telluride Bulk Alloys
journal, May 2008


Copper ion liquid-like thermoelectrics
journal, March 2012

  • Liu, Huili; Shi, Xun; Xu, Fangfang
  • Nature Materials, Vol. 11, Issue 5, p. 422-425
  • DOI: 10.1038/nmat3273

The panoscopic approach to high performance thermoelectrics
journal, January 2014

  • Zhao, Li-Dong; Dravid, Vinayak P.; Kanatzidis, Mercouri G.
  • Energy Environ. Sci., Vol. 7, Issue 1
  • DOI: 10.1039/C3EE43099E

Anisotropic normal-state transport properties predicted and analyzed for high- T c oxide superconductors
journal, May 1988

  • Allen, Philip B.; Pickett, Warren E.; Krakauer, Henry
  • Physical Review B, Vol. 37, Issue 13
  • DOI: 10.1103/PhysRevB.37.7482

Electronic structure calculations of solids using the WIEN2k package for material sciences
journal, August 2002