journal article·2024-12

Unfolding the mysterious roles of GeTe/SnTe compositing within CuInTe2 thermoelectric alloy: Short-range and local chemical orders

Wenxin Fan, Pengfei Yu, Lifeng Jiang, Zhen Tian, Erkuo Yang, Saichao Cao, Huijun Kang, Enyu Guo, Zongning Chen, Rongchun Chen, Mingxu Xia, Tongmin Wang

Acta Materialia· Volume 281
Publisher page

Abstract

The optimization of thermoelectric (TE) properties in TE materials requires controlling intrinsic factors such as order/disorder in crystal and chemical structures. Although heterogeneous interfaces play a key role in regulating TE properties, the corresponding atomic disorder-order has been ignored in composited systems. We demonstrate examples of GeTe/SnTe compositing for tuning CuInTe 2 TE properties. Evidences of increased short-range order and nanoclusters with local chemical order are presented via synchrotron X-ray pair distribution function and scanning transmission electron microscopy. Specifically, GeTe/SnTe compositing within CuInTe 2 enhances short-range order. Nanodomains of CuInTe 2(GeTe) x are accompanied by a significant atomic-intensity fluctuation that intensifies the scattering of phonons. In contrast to CuInTe 2(GeTe) x, nanoclusters with local chemical order are observed in CuInTe 2(SnTe) y, accompanied by a weak atomic-intensity fluctuation, which provides superior carrier transport channels and power factor for CuInTe 2(SnTe) 0.01. Ultimately, a maximum thermoelectric figure of merit zT of ∼1.0 is reported for CuInTe 2(SnTe) 0.01, which is 54 % greater than that of pristine CuInTe 2, and higher than the 0.86 for CuInTe 2(GeTe) 0.01. This work demonstrates new disorder-order insights that reveal the mysterious roles of compositing for tuning TE transport.
Source: expertdata · Quality: candidate unverified · Source record ↗

Research context

OpenAlex topics: Advanced Thermoelectric Materials and Devices · Chalcogenide Semiconductor Thin Films · Heusler alloys: electronic and magnetic properties

SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.

References (78)

Show source-provided references
1. Band engineering of high performance p-type FeNbSb based half-Heusler thermoelectric materials for figure of merit zT >110.1039/C4EE03042G ↗
2. High thermoelectric efficiency realized in SnSe crystals via structural modulation10.1038/s41467-023-37114-7 ↗
3. Electrical and thermal transport properties of Ge1–xPbxCuySbyTeSe2y10.1002/adfm.202304512 ↗
4. High-efficiency thermoelectric module based on high-performance Bi0.42Sb1.58Te3 materials10.1002/adfm.202305686 ↗
5. Surface oxide removal for polycrystalline SnSe reveals near-single-crystal thermoelectric performance10.1016/j.joule.2019.01.001 ↗
6. Polycrystalline SnSe with a thermoelectric figure of merit greater than the single crystal10.1038/s41563-021-01064-6 ↗
7. Modular nanostructures facilitate low thermal conductivity and ultra-high thermoelectric performance in n-type SnSe10.1002/adma.202203725 ↗
8. Simultaneously engineering electronic and phonon band structures for high-performance n-type polycrystalline SnSe10.1016/j.joule.2024.02.013 ↗
9. Engineering an atomic-level crystal lattice and electronic band structure for an extraordinarily high average thermoelectric figure of merit in n-type PbSe10.1039/D3EE01226C ↗
10. Atomic level defect structure engineering for unusually high average thermoelectric figure of merit in n-type PbSe rivalling PbTe10.1002/advs.202203782 ↗
11. Dense dislocations enable high-performance PbSe thermoelectric at low-medium temperatures10.1038/s41467-022-34227-3 ↗
12. Breaking the sodium solubility limit for extraordinary thermoelectric performance in p-type PbTe10.1039/D2EE01421A ↗
13. ZnTe alloying effect on enhanced thermoelectric properties of p-type PbTe10.1021/acsami.6b15295 ↗
14. Compromise and synergy in high-efficiency thermoelectric materials10.1002/adma.201605884 ↗
15. Ternary compound CuInTe2: a promising thermoelectric material with diamond-like structure10.1039/c2cc30318c ↗
16. Progressive regulation of electrical and thermal transport properties to high-performance CuInTe2 thermoelectric materials10.1002/aenm.201600007 ↗
17. Large enhancement of thermoelectric performance of CuInTe2 via a synergistic strategy of point defects and microstructure engineering10.1016/j.nanoen.2015.09.015 ↗
18. Ultralow thermal conductivity in diamondoid structures and high thermoelectric performance in (Cu1-xAgx)(In1-yGay)Te210.1021/jacs.1c01801 ↗
19. Thermoelectric performance of Cu1−x−δAgxInTe2 diamond-like materials with a pseudocubic crystal structure10.1039/C6QI00162A ↗
20. Ultralow thermal conductivity and improved ZT of CuInTe2 by highentropy structure design
21. A case of perfect convergence of light and heavy hole valence bands in SnTe: the role of Ge and Zn co-dopants10.1039/D2MA00315E ↗
22. Towards achieving an ideal convergence of light and heavy electron conduction bands in SnTe: Insights into copper doping
23. Mg/Ca doping ameliorates the thermoelectric properties of GeTe: influence of electronic structure engineering10.1016/j.jallcom.2020.155989 ↗
24. Resonance states and hyperconvergence induced by tungsten doping in SnTe: Multiband transport leading to a propitious thermoelectric material10.1016/j.jallcom.2022.164146 ↗
25. Tuning the electronic structure of rhombohedral and cubic GeTe for thermoelectric application: Influence of molybdenum doping10.1016/j.jpcs.2024.111943 ↗
26. Resonance levels in GeTe thermoelectrics: Zinc as a new multifaceted dopant10.1039/D0NJ04273K ↗
27. Improving the ZT of SnTe using electronic structure engineering: unusual behavior of Bi dopant in the presence of Pb as a co-dopant10.1039/D1MA00696G ↗
28. Vanadium: A protean dopant in SnTe for augmenting its thermoelectric performance10.1021/acssuschemeng.1c04749 ↗
29. Electronic structure modulation of Pb0.6Sn0.4Te via zinc doping and its effect on the thermoelectric properties10.1016/j.jallcom.2021.159681 ↗
30. Compositing effects for high thermoelectric performance of Cu2Se-based materials10.1038/s41467-023-38054-y ↗
31. Spontaneously promoted carrier mobility and strengthened phonon scattering in p-type YbZn2Sb2 via a nanocompositing approach10.1016/j.nanoen.2017.11.019 ↗
32. Origin of inhomogeneity in spark plasma sintered bismuth antimony telluride thermoelectric nanocomposites10.1007/s12274-019-2590-6 ↗
33. Enhancement of thermoelectric performance in a non-toxic CuInTe2/SnTe coated grain nanocomposite10.1039/D1TA02893F ↗
34. Strategy to optimize the overall thermoelectric properties of SnTe via compositing with its property-counter CuInTe210.1016/j.actamat.2016.11.049 ↗
35. Enhanced electrical, thermal, and mechanical properties of SnTe through equimolar multication alloying for suitable device applications10.1021/acsaem.3c02687 ↗
36. High thermoelectric and mechanical performance achieved by a hyperconverged electronic structure and low lattice thermal conductivity in GeTe through CuInTe2 alloying10.1039/D2TA09280H ↗
37. Silver atom off-centering in diamondoid solid solutions causes crystallographic distortion and suppresses lattice thermal conductivity10.1021/jacs.2c13179 ↗
38. Hidden local symmetry breaking in silver diamondoid compounds is root cause of ultralow thermal conductivity10.1002/adma.202202255 ↗
39. Exceptionally low thermal conductivity realized in the chalcopyrite CuFeS2 via atomic-level lattice engineering10.1016/j.nanoen.2022.106941 ↗
40. Enhanced atomic ordering leads to high thermoelectric performance in AgSbTe210.1126/science.abb3517 ↗
41. High figure-of-merit and power generation in high-entropy GeTe-based thermoelectrics10.1126/science.abq5815 ↗
42. Realizing high-ranged out-of-plane ZTs in n-type SnSe crystals through promoting continuous phase transition10.1002/aenm.201901334 ↗
43. Short and long range order of Half-Heusler phases in (Ti,Zr,Hf)CoSb thermoelectric compounds10.1016/j.actamat.2016.05.041 ↗
44. Manipulating lattice distortion to promote average thermoelectric power factor in metavalently bonded AgBiSe210.1016/j.actamat.2023.119260 ↗
45. FIT2D: a multi-purpose data reduction, analysis and visualization program10.1107/S1600576716000455 ↗
46. PDFgetX2: a GUI-driven program to obtain the pair distribution function from X-ray powder diffraction data10.1107/S0021889804011744 ↗
47. PDFfit2 and PDFgui: computer programs for studying nanostructure in crystals10.1088/0953-8984/19/33/335219 ↗
48. Simultaneous regulation of electrical and thermal transport properties in CuInTe2 by directly incorporating excess ZnX (X=S, Se)10.1016/j.nanoen.2016.12.023 ↗
49. Cu3BiS3: Two-dimensional coordination induces out-of-plane phonon scattering enabling ultralow thermal conductivity10.1002/anie.202315642 ↗
50. Bridging structural inhomogeneity to functionality: pair distribution function methods for functional materials development10.1002/advs.202003534 ↗
51. Bottom up chalcogenide thermoelectric materials from solution-processed nanostructures10.1002/admi.201700517 ↗
52. Significant ZT enhancement in p-type Ti(Co,Fe)Sb–InSb nanocomposites via a synergistic high-mobility electron injection, energy-filtering and boundary-scattering approach10.1016/j.actamat.2012.12.028 ↗
53. Recent advances in thermoelectric materials
54. Ultralow thermal conductivity in diamondoid lattices: high thermoelectric performance in chalcopyrite Cu0.8+yAg0.2In1-yTe210.1039/D0EE02323J ↗
55. Extrinsic photoconduction induced short-wavelength infrared photodetectors based on Ge-based chalcogenides
56. Stable Li-ion storage in Ge/N-doped carbon microsphere anodes10.1039/D0NR08804H ↗
57. Sn-doped ZnO for efficient and stable quantum dot light-emitting diodes via a microchannel synthesis strategy10.1039/D3NR04619B ↗
58. Enhancing thermoelectric properties of MCoSb-based alloys by entropy-driven energy-filtering effects and band engineering
59. Dense dislocations enable high-performance PbSe thermoelectric at low-medium temperatures10.1038/s41467-022-34227-3 ↗
60. Energy filtering of charge carriers: Current trends, challenges, and prospects for thermoelectric materials10.1002/adfm.201901789 ↗
61. Tunable quantum gaps to decouple carrier and phonon transport leading to high-performance thermoelectrics10.1038/s41467-022-33330-9 ↗
62. Short-range order in defective half-Heusler thermoelectric crystals10.1039/C8EE03654C ↗
63. Engineering half-Heusler thermoelectric materials using Zintl chemistry10.1038/natrevmats.2016.32 ↗
64. High performance thermoelectric materials: Progress and their applications10.1002/aenm.201701797 ↗
65. Data analysis for Seebeck coefficient measurements10.1063/1.4807697 ↗
66. Synergistic regulation of phonon and electronic properties to improve the thermoelectric performance of chalcogenide CuIn1−xGaxTe2:yInTe (x = 0–0.3) with in situ formed nanoscale phase InTe10.1002/aelm.201901141 ↗
67. Ultralow thermal conductivity and improved ZT of CuInTe2 by high-entropy structure design
68. Thermoelectric properties of CuInTe2/graphene composites10.1039/c3ce40334c ↗
69. Exceptionally high average power factor and thermoelectric figure of merit in n-type PbSe by the dualincorporation of Cu and Te10.1021/jacs.0c07712 ↗
70. Unique role of refractory Ta alloying in enhancing the figure of merit of NbFeSb thermoelectric materials10.1002/aenm.201701313 ↗
71. Thermoelectric power factor: Enhancement mechanisms and strategies for higher performance thermoelectric materials10.1016/j.mser.2015.08.001 ↗
72. Grain boundary scattering of charge transport in n-type (Hf,Zr)CoSb half-Heusler thermoelectric materials10.1002/aenm.201803447 ↗
73. High-performance n-type PbSe–Cu2Se thermoelectrics through conduction band engineering and phonon softening10.1021/jacs.8b10448 ↗
74. Doping-mediated stabilization of copper vacancies to promote thermoelectric properties of Cu2−xS10.1016/j.nanoen.2021.105991 ↗
75. Colloidal synthesis of diamond-like compound Cu2SnTe3 and thermoelectric properties of (Cu0.96InTe2)1−x(Cu2SnTe3)x solid solutions10.1016/j.cej.2021.129985 ↗
76. A2Cu3In3Te8 (A = Cd, Zn, Mn, Mg): A type of thermoelectric material with complex diamond-like structure and low lattice thermal conductivities10.1021/acsaem.9b02004 ↗
77. Realizing high thermoelectric performance in Cu2Te alloyed Cu1.15In2.29Te410.1039/C8TA10741F ↗
78. zT = 1.1 in CuInTe2 solid solutions enabled by rational defect engineering10.1021/acsaem.9b01241 ↗