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RESEARCH PAPER · Computational Condensed Matter · 2017

Assessing the thermoelectric properties of ScRhTe half-heusler compound

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Assessing the thermoelectric properties of ScRhTe half-heusler compoundOriginalMode Grüneisen parameters of an efficient thermoelectric half-Heusler16Electronic, optical and thermoelectric properties of Fe 2 ZrP compound determined via first-principles calculations34Optical and thermoelectric response of RhTiSb half-Heusler54A high-throughput descriptor for prediction of lattice thermal conductivity of half-Heusler compounds26TB-mBJ calculations of optical and thermoelectric properties of half-Heusler FeCrAs alloy29Thermoelectric and Half-Metallic Behavior of the Novel Heusler Alloy RbCrC: Ab initio DFT Study20First-principles calculations to investigate mechanical, optoelectronic and thermoelectric properties of half-Heusler p-type semiconductor BaAgP58Investigation of the Structural, Electronic, Elastic, Thermodynamic, and Thermoelectric Properties of HfXPb (X = Ni, Pd, Pt): First-Principles Study5First-Principles Investigation of Structural, Thermoelectric, and Optical Properties of Half-Heusler Compound ScRhTe under Varied Pressure6(Ti, V, Fe and Ni)-doped LiMgP half Heusler-induced Ferromagnetism stability: DFT approach4Optoelectronic and thermoelectronic properties of 3d, 4d, and 5d based semiconductor half-Heuslers (Ni/Pd/Pt)ScSb with narrow bandgap22Optoelectronic and Thermoelectric Properties of Zirconium Half-Heusler Alloys RhZrX (X = P, As, Sb, Bi): an ab-initio Investigation12Strain induced high thermoelectric performance of ScAgX (X=Si, Ge, Sn) half- Heusler alloys: A first principles approach5First-principles study of metallic full-heusler compound Ac2MgGa as a promising contact electrode for thermoelectric devices and energy applications2Accelerated prediction of temperature-dependent lattice thermal conductivity via ensembled machine learning models2Unveiling the structural, vibrational, elastic, optoelectronic and thermoelectric characteristics of alkali-yttrium based half-Heusler alloys XYC (X = K, Rb, Cs)0

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  1. Mode Grüneisen parameters of an efficient thermoelectric half-Heusler

    Journal of Applied Physics · 2018-11-20

    Hong-Jie Pang, Liu-Cheng Chen, Zi-Yu Cao, Hao Yu, Chenguang Fu, Tiejun Zhu, Alexander F. Goncharov, Xiao‐Jia Chen

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  2. Electronic, optical and thermoelectric properties of Fe 2 ZrP compound determined via first-principles calculations

    RSC Advances · 2019-01-01

    Esmaeil Pakizeh, Jaafar Jalilian, Mahnaz Mohammadi

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  3. Optical and thermoelectric response of RhTiSb half-Heusler

    International Journal of Modern Physics B · 2019-09-10

    Besbes Anissa, Djelti Radouan, Benaouda Bestani

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  4. A high-throughput descriptor for prediction of lattice thermal conductivity of half-Heusler compounds

    Journal of Physics D Applied Physics · 2020-04-15

    Jianghui Liu, Shihao Han, Guohua Cao, Zizhen Zhou, Caiyu Sheng, Huijun Liu

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  5. TB-mBJ calculations of optical and thermoelectric properties of half-Heusler FeCrAs alloy

    Optical and Quantum Electronics · 2020-09-01

    Djelti Radouan, Besbes Anissa, Benaouda Bestani

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  6. Thermoelectric and Half-Metallic Behavior of the Novel Heusler Alloy RbCrC: Ab initio DFT Study

    SPIN · 2020-10-01

    M. Hammou, Fatima Bendahma, Mohamed Mana, Sabria Terkhi, N. Benderdouche, Zoubir Aziz, Bachir Bouhafs

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  7. 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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  8. Investigation of the Structural, Electronic, Elastic, Thermodynamic, and Thermoelectric Properties of HfXPb (X = Ni, Pd, Pt): First-Principles Study

    Journal of Electronic Materials · 2022-03-02

    Azziz Zenati, Omar Arbouche, Fouzia Boukabrine, Hanifi Mebarki, Yahia Azzaz, Noureddine Moulay, M. Rabah

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  9. First-Principles Investigation of Structural, Thermoelectric, and Optical Properties of Half-Heusler Compound ScRhTe under Varied Pressure

    Crystals · 2022-10-17

    Junhong Wei, Yongliang Guo, Guangtao Wang

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  10. (Ti, V, Fe and Ni)-doped LiMgP half Heusler-induced Ferromagnetism stability: DFT approach

    International Journal of Modern Physics B · 2023-06-14

    Zakaryaa Zarhri, Younes Ziat, Hamza Belkhanchi, María del Carmen Torres Salazar

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  11. Optoelectronic and thermoelectronic properties of 3d, 4d, and 5d based semiconductor half-Heuslers (Ni/Pd/Pt)ScSb with narrow bandgap

    Computational Condensed Matter · 2023-07-01

    H.-E. M. Musa Saad, B. O. Alsobhi

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  12. Optoelectronic and Thermoelectric Properties of Zirconium Half-Heusler Alloys RhZrX (X = P, As, Sb, Bi): an ab-initio Investigation

    Journal of Inorganic and Organometallic Polymers and Materials · 2024-09-22

    Mumtaz Manzoor, Arti Saxena, Pramod K. Singh, Faizan Ahmad, Ramesh Sharma, Hamid Ullah, Dalia Fouad, Vipul Srivastava

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  13. Strain induced high thermoelectric performance of ScAgX (X=Si, Ge, Sn) half- Heusler alloys: A first principles approach

    Physica B Condensed Matter · 2025-06-05

    Rekha Rani, M. M. Sinha

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  14. 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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  15. Accelerated prediction of temperature-dependent lattice thermal conductivity via ensembled machine learning models

    Physical Review Materials · 2025-12-10

    Piyush Paliwal, Aftab Alam

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  16. Unveiling the structural, vibrational, elastic, optoelectronic and thermoelectric characteristics of alkali-yttrium based half-Heusler alloys XYC (X = K, Rb, Cs)

    Indian Journal of Physics · 2026-02-03

    Bilel Achir, Fatima Bendahma, N. Mehtougui, M. Mana, Samir BENTATA, N. Benderdouche, A. Righi, T. Lantri

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