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RESEARCH PAPER · Physical Chemistry Chemical Physics · 2020

High thermoelectric performance of topological half-Heusler compound LaPtBi achieved by hydrostatic pressure

Suiting Ning, Shan Xiu Huang, Ziye Zhang, Renqi Zhang, Ning Qi, Zhiquan Chen

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High thermoelectric performance of topological half-Heusler compound LaPtBi achieved by hydrostatic pressureOriginalThe thermal and electrical transport properties of layered LaCuOSe under high pressure34First-principles calculations to investigate mechanical, optoelectronic and thermoelectric properties of half-Heusler p-type semiconductor BaAgP58Effect of hydrostatic pressure on thermoelectric performance of topological half-Heusler LuPdBi compound5First-principles calculations to investigate Zr substitution enhanced thermoelectric performance of p-type ZrxHf1−xCoBi (x = 0,0.25,0.5,0.75,1) compounds17Topological phase and thermoelectric properties of bialkali bismuthide compounds (Na, K)2RbBi from first-principles6Rhodium-based half-Heusler alloys as thermoelectric materials10Attaining Low Lattice Thermal Conductivity in Half-Heusler Sublattice Solid Solutions: Which Substitution Site Is Most Effective?8Electronic structure and thermoelectric properties of orthorhombic spinel-derived AgInSnS4 compound: First-principles investigation1RPtBi: Magnetism and topology6First-principles insights into thermoelectric properties of topological nontrivial semimetal LiAuTe material4Two-Dimensional β-PdX2 (X=S, Se, and Te) Monolayers with Promising Potential for Thermoelectric Applications8Exploring structural, mechanical, and thermoelectric properties of half-Heusler compounds RhBiX (X = Ti, Zr, Hf): A first-principles investigation46A review of pressure manipulating structure and performance in thermoelectrics13Effective spin-orbital coupling determined topological properties of Half-Heusler compounds XYZ (X = Li, Na, K; Y = Ag, Au; Z = S, Se, Te)4Synthesis and characterization of half-Heusler ScPtBi films via three-source magnetron co-sputtering on Nb superconductor buffer layer1Structural and optoelectronic properties of LiYP (Y = Ca, Mg, and Zn) half-Heusler alloy under pressure: A DFT study30Role of volume change on the physics of thermoelectric half-Heusler compounds9Effect of Hydrostatic Pressure on the Thermoelectric Properties of a p-type HfIrBi Compound0First-principles study on the lattice dynamics, electronic, mechanical, and thermoelectric properties of half-heusler compounds TiXSn (X = Ni, Pd, Pt)15Modulation of thermoelectric properties of PbTe by hydrostatic pressure and uniaxial stress2Thermoelectric properties of doped topological half-Heusler LuPdBi1-xZx (Z = P, As, Sb) compounds0An Ab-initio Investigation of LiBeX (X = Sb, Bi) Semiconductors For Opto-electronic Applications1Ideal quadratic nodal point in half-Heusler semimetal LaPtBi2Effect of Pressure on Thermoelectric Performance of Half Heusler Compounds3Unravelling Optoelectronic and Transport Properties in RuZrX (X=Si, Ge) Alloys: Insights from DFT10Exploring the Physical Properties of LiBeX (X = Sb, Bi) Compounds via Ab Initio Approach2First-principles investigation of LiSnAl and LiSiIn half-Heusler compounds for optoelectronic applications7Strain trailing band engineering and phonon transport of high ZT ZrCoBi half-Heusler alloy: a mechanistic understanding from first principles5Investigating the Structural, Elastic, Pressure-Dependent Electronic and Optical Properties of Antiferromagnetic HoPdBi and HoPtBi Alloys3Thermoelectric Characteristics of Silver-Based Chalcopyrite Semiconductors: An Ab Initio Study Based on the Nonempirical Range-Separated Dielectric-Dependent Hybrid4Enhanced thermoelectric performance of half-Heusler compound HfIrAs via pressure-induced strain1Decoupling electronic transport properties: A combined physical and chemical pressure approach for boosting thermoelectric performance in skutterudites1Giant enhancement of thermoelectric power factor in compressed single crystal of MoSe22First-principles study of metallic full-heusler compound Ac2MgGa as a promising contact electrode for thermoelectric devices and energy applications2Unveiling the impact of bonding asymmetry on the lattice thermal conductivity of MnXS2Cl (X=Sb, Bi) for promising thermoelectric applications1Promise and challenges of Cs2MnS2: optoelectronic and thermoelectric properties for sustainable energy applications0First principles study of influence of exchange-correlation functionals on the electronic, optical and thermoelectric transport properties of XCoGe (X = V, Nb, Ta) half-Heusler alloys1

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  1. The thermal and electrical transport properties of layered LaCuOSe under high pressure

    Journal of Alloys and Compounds · 2020-11-20

    S. M. Feng, Ning Wang, Menglu Li, Haiyan Xiao, Zi‐Jiang Liu, Xiaotao Zu, Liang Qiao

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  2. First-principles calculations to investigate mechanical, optoelectronic and thermoelectric properties of half-Heusler p-type semiconductor BaAgP

    Results in Physics · 2021-03-18

    Fahmida Parvin, Md.A. Hossain, I. Ahmed, Karima Akter, A.K.M.A. Islam

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  3. Effect of hydrostatic pressure on thermoelectric performance of topological half-Heusler LuPdBi compound

    Physica Scripta · 2021-08-04

    Nisha, Hardev S. Saini, Sunita Srivastava, Manish K. Kashyap

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  4. First-principles calculations to investigate Zr substitution enhanced thermoelectric performance of p-type ZrxHf1−xCoBi (x = 0,0.25,0.5,0.75,1) compounds

    Physics Letters A · 2021-11-17

    Quanwei Jiang, Rundong Wan, Zhengfu Zhang, Ying Lei, Guocai Tian

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  5. Topological phase and thermoelectric properties of bialkali bismuthide compounds (Na, K)2RbBi from first-principles

    Journal of Physics Condensed Matter · 2021-12-14

    Shahram Yalameha, Zahra Nourbakhsh, Daryoosh Vashaee

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  6. Rhodium-based half-Heusler alloys as thermoelectric materials

    Physical Chemistry Chemical Physics · 2022-01-01

    Dhurba Raj Jaishi, Sujit Bati, Nileema Sharma, Bishnu Karki, Bishnu Prasad Belbase, Madhav Prasad Ghimire

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  7. Attaining Low Lattice Thermal Conductivity in Half-Heusler Sublattice Solid Solutions: Which Substitution Site Is Most Effective?

    Electronic Materials · 2022-01-05

    Rasmus Tranås, Ole Martin Løvvik, Kristian Berland

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  8. Electronic structure and thermoelectric properties of orthorhombic spinel-derived AgInSnS4 compound: First-principles investigation

    Computational Condensed Matter · 2022-03-16

    Z. Benhalima, Naouel Chelil, R. Larbi, Hamida Bouhani-Benziane, Mohammed SAHNOUN

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  9. RPtBi: Magnetism and topology

    MRS Bulletin · 2022-06-01

    Eundeok Mun, Sergey L. Bud’ko

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  10. First-principles insights into thermoelectric properties of topological nontrivial semimetal LiAuTe material

    Physica Scripta · 2022-06-08

    Ilham Kara, Zahira Faïza Meghoufel, Abdelkader Menad, Fatiha Cherifi, AbdelAziz Boukra

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  11. Two-Dimensional β-PdX2 (X=S, Se, and Te) Monolayers with Promising Potential for Thermoelectric Applications

    The Journal of Physical Chemistry C · 2022-10-15

    Suiting Ning, Shan Xiu Huang, Tingting Zhang, Ziye Zhang, Ning Qi, Zhiquan Chen

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  12. Exploring structural, mechanical, and thermoelectric properties of half-Heusler compounds RhBiX (X = Ti, Zr, Hf): A first-principles investigation

    RSC Advances · 2023-01-01

    Junhong Wei, Yongliang Guo, Guangtao Wang

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  13. A review of pressure manipulating structure and performance in thermoelectrics

    Journal of Physics D Applied Physics · 2023-02-24

    He Zhang, Cunyin Zhang, Duncan H. Gregory, Zhanxiang Yin, Yaqiang Wang, Pan He, Xin Guo

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  14. Effective spin-orbital coupling determined topological properties of Half-Heusler compounds XYZ (X = Li, Na, K; Y = Ag, Au; Z = S, Se, Te)

    Journal of Alloys and Compounds · 2023-06-25

    Qiulin Yuan, Minping Zhang, Gong-Ping Zheng, Guangtao Wang

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  15. Synthesis and characterization of half-Heusler ScPtBi films via three-source magnetron co-sputtering on Nb superconductor buffer layer

    Surfaces and Interfaces · 2023-06-28

    Ö. Polat, Michal Horák, Jon Ander Arregi, Kristýna Bukvišová, Jakub Zlámal, Tomáš Šikola

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  16. Structural and optoelectronic properties of LiYP (Y = Ca, Mg, and Zn) half-Heusler alloy under pressure: A DFT study

    Physica B Condensed Matter · 2023-08-10

    Mohammed Miri, Younes Ziat, Hamza Belkhanchi, Zakaryaa Zarhri, Youssef Ait El Kadi

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  17. Role of volume change on the physics of thermoelectric half-Heusler compounds

    Physical Review Materials · 2023-10-25

    M. Yazdani-Kachoei, Shaohan Li, Weiwei Sun, S. Mehdi Vaez Allaei, Igor Di Marco

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  18. Effect of Hydrostatic Pressure on the Thermoelectric Properties of a p-type HfIrBi Compound

    Journal of Electronic Materials · 2023-10-31

    Fanbin Hu, Rundong Wan, Zhengfu Zhang, Guocai Tian, Ying Lei

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  19. First-principles study on the lattice dynamics, electronic, mechanical, and thermoelectric properties of half-heusler compounds TiXSn (X = Ni, Pd, Pt)

    Materials Today Communications · 2024-01-06

    Mingyao Xiong, Shumin Yang

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  20. Modulation of thermoelectric properties of PbTe by hydrostatic pressure and uniaxial stress

    Journal of Applied Physics · 2024-02-12

    Yang Xiang, Yi Sun, Jianbo Hu

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  21. Thermoelectric properties of doped topological half-Heusler LuPdBi1-xZx (Z = P, As, Sb) compounds

    Journal of Materials Science Materials in Electronics · 2024-04-01

    Narender Kumar, Hardev S. Saini, Nisha Sheoran, Manish K. Kashyap

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  22. An Ab-initio Investigation of LiBeX (X = Sb, Bi) Semiconductors For Opto-electronic Applications

    Research Square · 2024-04-09

    Muhammad Mazhar, Atia Atiq, Qura Tul Ain, Farah Andleeb, Iqra Imran, Aqsa Manzoor, Muhammad Nasir Rasul

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  23. Ideal quadratic nodal point in half-Heusler semimetal LaPtBi

    Materials Today Communications · 2024-09-16

    Yang Li

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  24. Effect of Pressure on Thermoelectric Performance of Half Heusler Compounds

    Inorganic Chemistry Communications · 2024-09-26

    Bindu Rani, Shakeel Ahmad Khandy, Marutheeswaran Srinivasan, Atif Mossad Ali, Shobhna Dhiman, Kulwinder Kaur

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  25. Unravelling Optoelectronic and Transport Properties in RuZrX (X=Si, Ge) Alloys: Insights from DFT

    Advanced Theory and Simulations · 2024-10-08

    Bharti Gurunani, Dinesh C. Gupta

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  26. Exploring the Physical Properties of LiBeX (X = Sb, Bi) Compounds via Ab Initio Approach

    physica status solidi (b) · 2024-10-25

    Muhammad Mazhar, Farah Andleeb, Iqra Imran, Alina Manzoor, Saima Altaf, Muhammad Rafiq, Muhammad Nasir Rasul

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  27. First-principles investigation of LiSnAl and LiSiIn half-Heusler compounds for optoelectronic applications

    RSC Advances · 2025-01-01

    Mohshina Binte Mansur, Tasmi Akter, Istiak Ahmed Ovi, Jahirul Islam, Wahidur Rahman Sajal

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  28. Strain trailing band engineering and phonon transport of high ZT ZrCoBi half-Heusler alloy: a mechanistic understanding from first principles

    Physical Chemistry Chemical Physics · 2025-01-01

    Suman Mahakal, Avijit Jana, Subrata Jana, Prasanjit Samal

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  29. Investigating the Structural, Elastic, Pressure-Dependent Electronic and Optical Properties of Antiferromagnetic HoPdBi and HoPtBi Alloys

    NANO · 2025-02-05

    Mahdi Abane, Tahar Bouguetaia, Soumia Bahlouli, Mokhtar Elchikh, Said Hiadsi

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  30. Thermoelectric Characteristics of Silver-Based Chalcopyrite Semiconductors: An Ab Initio Study Based on the Nonempirical Range-Separated Dielectric-Dependent Hybrid

    The Journal of Physical Chemistry C · 2025-02-12

    Dimple Rani, Subrata Jana, Manish K. Niranjan, Prasanjit Samal

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  31. Enhanced thermoelectric performance of half-Heusler compound HfIrAs via pressure-induced strain

    Physica Scripta · 2025-08-21

    Menghao Wang, Ke Shi, Fuhao Qi, J. L. Zhang, M.H. Ye, Mengke Wang, C. M. Wang, R. J. Zhang

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  32. Decoupling electronic transport properties: A combined physical and chemical pressure approach for boosting thermoelectric performance in skutterudites

    Materials Today Physics · 2025-10-28

    Álvaro Lobato, Elena R. Remesal, Antonio M. Márquez, Fernando Izquierdo‐Ruiz, Alberto Otero‐de‐la‐Roza, Ernesto J. Blancas, José Manuel Recio, José J. Plata

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  33. Giant enhancement of thermoelectric power factor in compressed single crystal of MoSe2

    Journal of Alloys and Compounds · 2025-10-28

    Natalia V. Morozova, Aleksandr Yu. Usik, Igor V. Korobeinikov, С. В. Наумов, Sergey V. Ovsyannikov

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  34. First-principles study of metallic full-heusler compound Ac2MgGa as a promising contact electrode for thermoelectric devices and energy applications

    Scientific Reports · 2025-11-18

    M. M. Rabbi

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  35. Unveiling the impact of bonding asymmetry on the lattice thermal conductivity of MnXS2Cl (X=Sb, Bi) for promising thermoelectric applications

    Chinese Journal of Physics · 2026-01-24

    Suiting Ning, Ziye Zhang, Xiaochen Liu, Zhiquan Chen

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  36. Promise and challenges of Cs2MnS2: optoelectronic and thermoelectric properties for sustainable energy applications

    Journal of Materials Science · 2026-07-18

    M. M. Rabbi, M. A. Hossain, Mst. Asma Khatun, Fahmida Parvin, A. K. M. A. Islam

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  37. First principles study of influence of exchange-correlation functionals on the electronic, optical and thermoelectric transport properties of XCoGe (X = V, Nb, Ta) half-Heusler alloys

    Next Materials · 2026-07-20

    G.C. Lalremruata, Lalro Sanga, H. Lalremruatpuii, Joel Lalbiakkima, Lalmuan Chhana, Malsawm tluanga, Zaithanzauva Pachuau

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