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RESEARCH PAPER · Materials Today Proceedings · 2023

Thermoelectric performance of PdTiSn half Heusler compound facilitated by structural and dynamical stability: A first principle study

Bindu Rani, Aadil Fayaz Wani, Kulwinder Kaur, Shobhna Dhiman

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Thermoelectric performance of PdTiSn half Heusler compound facilitated by structural and dynamical stability: A first principle studyOriginalElastic anisotropy, mechanical, lattice dynamics, and electronic properties of MPdZ (M = Hf, Zr, Ti; Z = Sn, Ge, Si). DFT study8Anti-Wilson mechanism for adjusting bandgap and electronic transport property of a half-Heusler material LiCdP0First-principles calculations to investigate optoelectronic of transition-metal half-Heusler alloys MTiSn (M = Pd and Pt) for optoelectronics applications7Effect of strain on the stability, electronic structure and thermoelectric characteristics of (PdXSn, X = Zr, Hf) half-Heusler compounds: a first-principles study5First-principles calculations to investigate structural, mechanical, electronic, transport and thermoelectric properties of XTiPd(X=Si, Ge, Sn, Pb) Half Heusler alloys5Structural, Magnetic, Electronic, and Optical Properties of New Half-Metallic Half-Heusler Alloys MVSn (M = Pd and Pt): First-Principles DFT Study3Strain induced high thermoelectric performance of ScAgX (X=Si, Ge, Sn) half- Heusler alloys: A first principles approach5

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  1. Elastic anisotropy, mechanical, lattice dynamics, and electronic properties of MPdZ (M = Hf, Zr, Ti; Z = Sn, Ge, Si). DFT study

    Computational Condensed Matter · 2024-03-26

    Edward L. Tindibale, Winfred Mueni Mulwa, Bamidele Ibrahim Adetunji

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  2. Anti-Wilson mechanism for adjusting bandgap and electronic transport property of a half-Heusler material LiCdP

    Physica Scripta · 2024-08-19

    Shuo Zhao, Mingfeng Zhu, Liwei Jiang, Yisong Zheng

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  3. First-principles calculations to investigate optoelectronic of transition-metal half-Heusler alloys MTiSn (M = Pd and Pt) for optoelectronics applications

    Chemical Physics · 2024-09-25

    M. Musa Saad H.‐E., B. O. Alsobhi

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  4. Effect of strain on the stability, electronic structure and thermoelectric characteristics of (PdXSn, X = Zr, Hf) half-Heusler compounds: a first-principles study

    Discover Applied Sciences · 2025-02-22

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

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  5. First-principles calculations to investigate structural, mechanical, electronic, transport and thermoelectric properties of XTiPd(X=Si, Ge, Sn, Pb) Half Heusler alloys

    Journal of Physics and Chemistry of Solids · 2025-03-15

    Athira Mohan, Rita John

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  6. Structural, Magnetic, Electronic, and Optical Properties of New Half-Metallic Half-Heusler Alloys MVSn (M = Pd and Pt): First-Principles DFT Study

    Russian Journal of Physical Chemistry A · 2025-05-01

    M. Musa Saad H.‐E., B. O. Alsobhi

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  7. 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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