Synthesis, transport properties and electronic structure of p-type Cu1+: XMn2- xInTe4 (x = 0, 0.2, 0.3)

Dean Hobbis, Wencong Shi, Adrian Popescu, Kaya Wei, Ryan E. Baumbach, Hsin Wang, Lilia M. Woods, George S. Nolas

Research output: Contribution to journalArticlepeer-review

13 Scopus citations

Abstract

The synthesis, electronic structure and temperature dependent transport properties of polycrystalline Cu1+xMn2-xInTe4 (x = 0, 0.2, 0.3) are reported for the first time. These quaternary chalcogenides were synthesized by direct reaction of the elements, followed by solid state annealing and hot press densification. The thermal conductivity is low for all specimens and intrinsic to the material system. Furthermore, the off-stoichiometry specimens illustrate the sensitivity of the transport properties to stoichiometry, with a greater than two-orders-of magnitude increase in carrier concentration with increased Cu content. First principles calculations of the electronic structure are also reported, and are in agreement with the experimental data. This fundamental investigation shows the potential towards further optimization of the electrical properties that, in addition to the intrinsically low thermal conductivity, provides a basis for further research into the viability of this material system for potential energy-related applications.

Original languageEnglish
Pages (from-to)2273-2279
Number of pages7
JournalDalton Transactions
Volume49
Issue number7
DOIs
StatePublished - Feb 21 2020

Funding

DMR-1748188. D. H. acknowledges support from the II-VI Foundation Block-Gift program. K. W. acknowledges the support of the Jack E. Crow Postdoctoral Fellowship. A portion of this work was performed at the National High Magnetic Field Laboratory, which is supported by the National Science Foundation Cooperative Agreement No. DMR-1644779 and the State of Florida. H. W. acknowledges support of the International Energy Agency (IEA) Advanced Materials For Transportation and the Department of Energy Lightweight and Propulsion Materials program under the Vehicle Technologies Office. Oak Ridge National Laboratory is managed by UT-Battelle LLC under contract DE-AC05000OR22725. The use of University of South Florida Research Computing Facilities is also acknowledged. The authors also thank Dr A. R. Khabibullin for his assistance with this paper. The authors acknowledge financial support from the U.S. National Science Foundation (NSF) under Grant No.

FundersFunder number
II-VI Foundation Block-Gift Program
U.S. National Science Foundation
UT-Battelle LLCDE-AC05000OR22725
National Science Foundation1748188
Oak Ridge National Laboratory
International Atomic Energy Agency

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