Achieving high thermoelectric performance of triple half-Heusler compositions enabled by high-throughput screening

Kazuki Imasato, Haruhiko Morito, Hidetoshi Miyazaki, Fumikazu Hosono, Philipp Sauerschnig, Masanobu Miyata, Takao Ishida, Atsushi Yamamoto, Yukari Katsura and Michihiro Ohta

J. Mater. Chem. A, 2025, 13, 39042
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Thermoelectric properties of the aliovalent half-Heusler alloy Zn0.5Ti0.5NiSb with intrinsic low thermal conductivity

Blair F. Kennedy, Simon A. J. Kimber, Stefano Checchia, A. K. M. Ashiquzzaman Shawon, Alexandra Zevalkink, Emmanuelle Suard, Jim Buckman and Jan-Willem G. Bos

J. Mater. Chem. A, 2023, 11, 23566
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Recent advances and challenges in thermoelectrics toward near-room-temperature and high-temperature applications

Qianhui Lou, Jiayan Gong, Zizheng Zang, Sheng Qian, Yu Liu, Yu Zhang, Yuechu Wang, Shen Han, Chenguang Fu and Tiejun Zhu

Chem. Soc. Rev., 2026, 55, 2265
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Effects of the Fe/Ni ratio in double half-Heusler composition HfFe1−xNixSb

Kazuki Imasato, Philipp Sauerschnig, Masanobu Miyata, Takao Ishida, Atsushi Yamamoto and Michihiro Ohta

J. Mater. Chem. C, 2025, 13, 2154
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Asymmetric Thermoelectric Performance Tuning in Low-Cost ZrFexNi1–xSb Double Half-Heusler Materials

Joseph Ngugi Kahiu, Samuel Kimani Kihoi, Hyunji Kim, U. Sandhya Shenoy, D. Krishna Bhat and Ho Seong Lee

ACS Appl. Energy Mater., 2023, 6, 4305
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Optimizing grain boundary potential barriers for enhanced thermoelectric performance of NbFeSb alloy

Chang Tan, Adeel Abbas, Hongxiang Wang, Zhihao Li, Yuqing Sun, Yujie Zong, Hui Sun, Chunlei Wang and Hongchao Wang

Cell Reports Physical Science, 2024, 5, 101799
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Precision Interface Engineering of CuNi Alloys by Powder ALD Toward Better Thermoelectric Performance

Shiyang He, Amin Bahrami, Chanwon Jung, Xiang Zhang, Ran He, Zhifeng Ren, Siyuan Zhang and Kornelius Nielsch

Adv Funct Materials, 2024, 34
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Thermoelectric Transport of a Novel Zr‐Based Half‐Heusler High‐Entropy Alloy

Chalchisa Getachew Adamo, Ashutosh Srivastava, Surafel Shiferaw Legese, Yoshihito Kawamura, Ayansa Tolesa Serbesa, Sreeram Punathil Raman, Femi Emmanuel Olu, Chandra Sekhar Tiwary, Abhishek Kumar Singh and Kamanio Chattopadhyay

Energy Tech, 2024, 12
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RETRACTED ARTICLE: Electronic, thermodynamic, optical, and thermoelectric properties of Sr2RuO4 compound: Ab-initio principle

N. Maaouni, A. Jabar, S. Benyoussef, N. Tahiri and L. Bahmad

Opt Quant Electron, 2024, 56
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First-principles studies on structural, elastic, electronic, optical, thermodynamic and thermoelectric properties of RbScC and CsScC half-Heusler alloys

Fatima Sidjilani, Fadila Belkharroubi, Y. Al-Douri, Fatima Hamdache, Samia Bahlouli, Sid Ahmed Bendella, Hayat Sediki, Friha Khelfaoui, Anis Samy Amine Dib, Mohammed Noureddine Belkaid and Riyadh A. Al-Samarai

Eur. Phys. J. B, 2025, 98
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Advanced materials for next-generation devices: insights into the structural, optical, and thermoelectric properties of Hf2Pd2AlBi and Hf2Pd2AlSb alloys

Abdelhak Khatar, Mohammed Houari, Tayeb Lantri, Samir Bentata, Bouabdellah Bouadjemi, Zoubir Aziz, Ahmed Boucherdoud and Mokhtar Boudjelal

Indian J Phys, 2025, 99, 4109
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Entropy Engineering in the Off-Stoichiometric Ti2NiCoSn0.5Sb1.5 Double Half-Heusler Alloy

Soumya Ranjan Mishra, Pattamadai Sundaram Sankara Rama Krishnan, Karl P. Davidson, Raju Vijayaraghavan Ramanujan and Budaraju Srinivasa Murty

ACS Appl. Energy Mater., 2025, 8, 3715
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Water-Free SbOx ALD Process for Coating Bi2Te3 Particles

Sebastian Lehmann, Fanny Mitzscherling, Shiyang He, Jun Yang, Martin Hantusch, Kornelius Nielsch and Amin Bahrami

Coatings, 2023, 13, 641
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A study of the properties of ZrNiSb defective half-Heusler alloy for thermoelectric and spintronic applications

Joseph Ngugi Kahiu and Ho Seong Lee

Journal of Alloys and Compounds, 2025, 1041, 183729
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Improved thermoelectric properties of n-type ZrNiCu0.05Sn by doping Y2O3

Lin Liu, Kaiyi Luo, Pingping Qian, Haowen Chen, Lei Cao, Yixiao Deng, Lei Yang, Kaibin Fu and Jun Tang

Ceramics International, 2024, 50, 54505
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Discovery of (Sc,V)CoSb double half-Heusler alloys with low lattice thermal conductivity

Xin Liu, Shaoqin Wang, Zirui Dong, Yi Chang, Jiye Zhang, Xinyue Zhang and Jun Luo

Journal of Alloys and Compounds, 2025, 1010, 178078
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High‐Performance Thermoelectric and Electromagnetic Interference Shielding Derived from MXene/Ag2Se Nanowire Composite Film

Dabin Park, Minsu Kim and Jooheon Kim

Adv Elect Materials, 2024, 10
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Structure and Thermoelectric Properties of Mg1–xTixNiSb Quaternary Half-Heusler Alloys

Xin Liu, Shaoqin Wang, Yi Chang, Jiutian Liao, Zirui Dong, Jiye Zhang, Xinyue Zhang and Jun Luo

ACS Appl. Energy Mater., 2024, 7, 2285
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Strategies to Suppress Thermal Conductivity in Half-Heusler Compounds for Thermoelectric Applications: A Comprehensive Review

Sayan Paul, Supriya Ghosal and Swapan K. Pati

ACS Appl. Energy Mater., 2025, 8, 15585
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Low-temperature ALD of highly conductive antimony films through the reaction of silylamide with alkoxide and alkylamide precursors

S. He, A. Bahrami, X. Zhang, J. Julin, M. Laitinen and K. Nielsch

Materials Today Chemistry, 2023, 32, 101650
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Electronic, elastic, optic, thermal dynamic, and thermoelectric properties of the half-Heusler compounds ZrCoBi and TiCoBi

Shao-Bo Chen, Wan-Jun Yan and Ting-Hong Gao

Eur. Phys. J. Plus, 2023, 138
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Compressive strain-induced enhancement of thermoelectric performance in lead-free halide double perovskites K2SnX6 (X = I, Br, Cl)

Un-Gi Jong, Su-Hyang Kim, Ryong-Wan Ham, Song Ri, Ryong-Jin Ri and Chol-Jun Yu

Applied Physics Letters, 2024, 125
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Ab Initio Study of the Properties of Ti2PdFe(Ru)Sb2 Double Half-Heusler Semiconducting Alloys

Mohamed Diaf, Haroun Righi, Habib Rached, Djamel Rached and Raouf Beddiaf

J. Electron. Mater., 2023, 52, 6514
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Exploring composition space by Nb and Sn substitution, microstructure and Seebeck behaviour in Zr2FeNiSb2 double half-Heusler compound

Dharita Chandravanshi, Dipanjan Kumar, Y. Kawamura, K. Ramesh, N. Ravishankar, Praveen C. Ramamurthy and Kamanio Chattopadhyay

J Mater Sci, 2025, 60, 2449
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Interfacial charge transfer and thermoelectric optimization in MoS2 enabled by secondary-doped PANI intercalation

Wei Guo, Xiaofeng Li, Yunfei Lu, Taihua Zhang, Xueting Chang, Tao Liu and Yan An

Next Materials, 2026, 12, 101945
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Comprehensive Study of ZrNiIn0.5Sb0.5 Double Half-Heusler Properties for Thermoelectric and Spintronics Applications: Intrinsic Homogeneity Optimization and Extrinsic Sc Doping Effects

Joseph Ngugi Kahiu, Samuel Kimani Kihoi, Hyunji Kim, Innocent Thato Marekwa, Donghyun Shin and Ho Seong Lee

ACS Appl. Energy Mater., 2025, 8, 2523
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Enhanced performance of graphite/NiO ink-based flexible thermoelectric generators via compositional gradient and annealing of NiO nanoparticles

Ramakrishna Nayak, Prakasha Shetty, M. Selvakumar, Ashok Rao, Mohan K. Rao, Murari Mudiyaru Subrahmanya, Akshayakumar Kompa and Deepika U. Shanubhogue

J Mater Sci, 2023, 58, 4901
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Comprehensive First-Principles Study of Structural, Electronic, Mechanical, Optical, and Thermoelectric Properties of Fe-Based Half-Heusler Compounds

Suman Mahakal, Subrata Jana, Prasanjit Samal and Kartick Malik

ACS Appl. Energy Mater., 2025, 8, 17416
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Electronic structure and elastic properties of double half-Heusler thermoelectric materials MgXY2Z2 (X=Zr/Hf, Y=Pd/Pt, Z=Bi/Sb)

A.N. Filanovich, A.V. Lukoyanov and A.A. Povzner

Physica B: Condensed Matter, 2023, 669, 415280
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Theoretical insights into the electronic, optical, mechanical and thermoelectric characteristics of double half-Heusler Nb2Sn2OsZ(Z=Pd,Pt)

A. Zikem, H. Baaziz, T. Saadi, T. Ghellab and Z. Charifi

Int. J. Mod. Phys. B, 2026
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In-situ formation of CrB minor phase during reactive spark plasma sintering leads to the enhancement in the electrical transport performance of boron doped chromium disilicide

Manju Yadav, Durgesh Kumar Sharma, Kishor Kumar Johari, Naval Kishor Upadhyay, Radhey Shyam, Sudhir Kumar, Saravanan Muthiah and Bhasker Gahtori

Materials Chemistry and Physics, 2024, 316, 129004
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Double half-Heusler alloys X2Ni2InSb ( X = Zr , Hf ) with promising thermoelectric performance: The role of varying structural phases

Bhawna Sahni and Aftab Alam

Phys. Rev. Applied, 2024, 22
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Electronic, optical, elastic, and thermal properties of the half-Heusler-derived Ti2FeNiSb2: A DFT study

Shao-Bo Chen, San-Dong Guo, Bing Lv and Yee Sin Ang

Physica B: Condensed Matter, 2024, 689, 416201
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Poorer is better: towards robust, high performance Mg2(Si,Sn) thermoelectric material by avoiding excess Mg

Amandine Duparchy, Harshita Naithani, Sanyukta Ghosh, Michael Parzer, Fabian Garmroudi, Eckhard Müller and Johannes de Boor

Energy Mater., 2025, 5
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Thermoelectric properties of Electro-Sinter Forged ZrNiSn

Vidushi Galwadu Arachchige, Sébastien Recalcati, Jürgen Rossa, Songhak Yoon, Konstantin Skokov, Iliya Radulov and Sebastian Klemenz

Journal of Alloys and Compounds, 2025, 1045, 184694
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A critical review on medium- and high-entropy thermoelectric alloys

Rong-Chun Chen, Xiao-Lei Shi, Hui-Jun Kang, En-Yu Guo, Zong-Ning Chen, Yi-Ping Lu, Tong-Min Wang and Zhi-Gang Chen

Materials Today, 2025, 90, 815
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MnNiSi Half-Heusler Alloy: Computational and experimental insights for energy harvesting and spintronic applications

Beenaben S S, Radha Sankararajan, Srinivasan Manickam, KlintonBrito K and Prasath M

Chemical Physics Impact, 2025, 10, 100891
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