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RESEARCH PAPER · Materials Science in Semiconductor Processing · 2022

Analysis of Mg-based spinels MgGd2X4 (X = S, Se) for spintronic and thermoelectric device applications: Ab-initio calculations

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Analysis of Mg-based spinels MgGd2X4 (X = S, Se) for spintronic and thermoelectric device applications: Ab-initio calculationsOriginalHeteroatoms (Si, B, N, and P) doped 2D monolayer MoS 2 for NH 3 gas detection99Effects of Fe occupancy on physical properties of non-magnetic GeGa2O4 spinel oxide6Study of role of spin in ferromagnetism and thermoelectric characteristics of spinel chalcognides MgEr2(S/Se)4 for spintronic and clean energy12Formation and Characterization of MgSe Alloys by Pulsed Laser Welding Technique1Study of spin control on half metallic ferromagnetism and thermoelectric properties of MgEu2(S/Se)4 for spintronic and energy harvesting devices9Electronic Structure Property and Disposal Efficiency of 2,2-Dichloropropionic Acid Using Metalloid (B, Si and Ge)-Decorated Gallium Nano-clusters (Ga12X12 (X = N, O))15Electronic, magnetic and transport properties of anti-ferromagnetic semiconductor BaGd2X4(X S, Se)36Rare earth based MgPm2X4 (X = S, Se) spinel chalcogenides for spintronic and thermoelectric applications15First-principle study of Mg-based rare earth spinels MgSm2Y4 (Y S, Se) for spintronic and thermoelectric devices10Computational study of Cd-based chalcogenide spinels CdSm2(S/Se)4 for spintronic applications11Rare earth based Mg- chalcogenides MgDy2(S/Se)4 as an emerging aspirant for spintronic and thermoelectric applications25Study of electronic, mechanical, thermodynamic, optical, and thermoelectric properties of CdLa2X4 (X = S, Se, Te) chalcogenides for solar cells and energy applications1First principle investigation of half metallic ferromagnetism and thermoelectric behavior of MgSm2(S/Se)4 spinels for spintronic and energy harvesting applications9Half metallic ferromagnetic and transport behavior of rare earth based CdGd2(S/Se)4 spinels8Insights into the optoelectronic, thermodynamic, and thermoelectric properties of novel BaYCuX3 (X = Se, Te) semiconductors from first-principles investigation3Exploring the physical properties of novel ACu3S3 (A = Sc, Y) semiconductors via first-principles calculation3Study of the electronic, magnetic, and thermoelectric aspects of spinel chalcogenides SrCe 2 Z 4 (Z = Te, Se, S) for spintronic and energy applications5NiVX (X=Si & Ge) Heuslerene: A ferromagnetic semiconductor for thermoelectric and spintronics applications through DFT study2Spin-polarized analysis of ferromagnetism, optoelectronic and transport characteristics of HgGd2(S/Se)4 spinels: DFT-calculations4Electronic, magnetic, thermoelectric and optoelectronic properties of CaPr2(S/Se)4 for spintronic and energy applications2Thermoelectric Performance of SnMg2O4 Spinel Oxide for Energy Applications0Investigation of Curie temperature, magnetic, and transport aspects of CaEr2(S/Se)4 chalcogenides for spintronic applications2Exploring the electronic, optical, and thermoelectric properties of novel CsLaMTe3 (M = Cd, Zn) materials for sustainable energy harvesting4Discovery of a Compound near Mg 3 Sb 2 in the Mg–Sb–Ni System: The Crystal Structure, Stability, and Thermoelectric Performance0Engineering phonon anharmonicity and electronic band convergence in Mg3XY (X = Si, Ge; Y = S, Se, Te) monolayers for high thermoelectric performance0First-principles study of ferromagnetism and thermoelectric aspects of Sr(Pr/Nd)2S4 spinel chalcogenides as promising aspirants for spintronic and energy applications0Antiferromagnetic semiconductor SrGd2X4 (X = S/Se) as a promising multifunctional material for photocatalytic hydrogen generation and energy harvesting: A first-principles study0

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  1. Heteroatoms (Si, B, N, and P) doped 2D monolayer MoS 2 for NH 3 gas detection

    RSC Advances · 2022-01-01

    Terkumbur Emmanuel Gber, Hitler Louis, Aniekan Ekpenyong Owen, Benjamin E. Etinwa, Innocent Benjamin, Fredrick C. Asogwa, Muyiwa Michael Orosun, Ededet A. Eno

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  2. Effects of Fe occupancy on physical properties of non-magnetic GeGa2O4 spinel oxide

    Journal of Physics and Chemistry of Solids · 2023-03-15

    Muhammad Rafiq, Altaf Hussain, Athar Javed, Gul Naz, Jalil-ur Rehman, Muhammad Sohail Akbar

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  3. Study of role of spin in ferromagnetism and thermoelectric characteristics of spinel chalcognides MgEr2(S/Se)4 for spintronic and clean energy

    Journal of Solid State Chemistry · 2023-05-22

    Hind Mohammed Albalawi, Amel Azazi, Qasim Mahmood, Nessrin Awadhallah Kattan, Samah Al‐Qaisi, G. Murtaza, Filiz Ercan, S. Bouzgarrou, M. Jadan

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  4. Formation and Characterization of MgSe Alloys by Pulsed Laser Welding Technique

    Crystal Research and Technology · 2023-05-31

    Reim Abdullah Almotiri, A. F. Qasrawi

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  5. Study of spin control on half metallic ferromagnetism and thermoelectric properties of MgEu2(S/Se)4 for spintronic and energy harvesting devices

    Journal of Physics and Chemistry of Solids · 2023-07-28

    Qasim Mahmood, Shaista Tahir, Hind Mohammed Albalawi, Taharh Zelai, Othman Hakami, Samah Al‐Qaisi, Md. Ferdous Rahman, Abdulaziz I. Aljameel, G. Murtaza, Mohamed Adam

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  6. Electronic Structure Property and Disposal Efficiency of 2,2-Dichloropropionic Acid Using Metalloid (B, Si and Ge)-Decorated Gallium Nano-clusters (Ga12X12 (X = N, O))

    Journal of Computational Biophysics and Chemistry · 2023-08-28

    Fredrick C. Asogwa, Hitler Louis, Terkumbur Emmanuel Gber, Bienfait Kabuyaya Isamura, Stephen A. Adalikwu

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  7. Electronic, magnetic and transport properties of anti-ferromagnetic semiconductor BaGd2X4(X S, Se)

    Materials Science in Semiconductor Processing · 2023-10-03

    Xiao-Ping Wei, Lan-Lan Du, Jing Shen, Zi‐Qi Sun, Zi‐Meng Zhang, Wen‐Li Chang, Xiaoma Tao

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  8. Rare earth based MgPm2X4 (X = S, Se) spinel chalcogenides for spintronic and thermoelectric applications

    Journal of Rare Earths · 2023-10-27

    Tariq M. Al-Daraghmeh, Omar Zayed, Ghulam Mustafa, Taharh Zelai, Bisma Younas, Hind Mohammed Albalawi, S. Bouzgarrou, Othman Hakami, Qasim Mahmood, Khaild I. Hussein

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  9. First-principle study of Mg-based rare earth spinels MgSm2Y4 (Y S, Se) for spintronic and thermoelectric devices

    Materials Chemistry and Physics · 2023-12-05

    Huda A. Alburaih, Naveed Ahmad Noor, M. Bououdina, Hamid Ullah, A. Laref, Ramesh Sharma

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  10. Computational study of Cd-based chalcogenide spinels CdSm2(S/Se)4 for spintronic applications

    Chalcogenide Letters · 2024-01-01

    Sajid Maqsood, Muhammad Ammar Javed, Shahid Mumtaz, Mohammad K. Al-Sadoon

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  11. Rare earth based Mg- chalcogenides MgDy2(S/Se)4 as an emerging aspirant for spintronic and thermoelectric applications

    Materials Science in Semiconductor Processing · 2024-01-13

    Ghazanfar Nazir, Ayman S. Alofi, Adeela Rehman, Qasim Mahmood, Murefah mana Al‐Anazy, Rachid Karmouch, Md. Ferdous Rahman, El Sayed Yousef

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  12. Study of electronic, mechanical, thermodynamic, optical, and thermoelectric properties of CdLa2X4 (X = S, Se, Te) chalcogenides for solar cells and energy applications

    Physica Scripta · 2024-03-11

    Fekhra Hedhili, Jabir Wali Hakami, Hissah Saedoon Albaqawi, Waed R. Alahmad, Qasim Mahmood

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  13. First principle investigation of half metallic ferromagnetism and thermoelectric behavior of MgSm2(S/Se)4 spinels for spintronic and energy harvesting applications

    Chinese Journal of Physics · 2024-04-26

    Ghulam Mustafa, Hanof Dawas Alkhaldi, Sadaf Saba, A. Almeshal, Ayman S. Alofi, Murefah mana Al‐Anazy, Abdulaziz I. Aljameel, Abdulaziz A. Alshihri, Qasim Mahmood

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  14. Half metallic ferromagnetic and transport behavior of rare earth based CdGd2(S/Se)4 spinels

    Materials Today Communications · 2024-06-13

    Ghulam M. Mustafa, Bisma Younas, Sadaf Saba, Naveed Ahmad Noor, Yasir Saeed, Sohail Mumtaz, Mohammad K. Al-Sadoon

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  15. Insights into the optoelectronic, thermodynamic, and thermoelectric properties of novel BaYCuX3 (X = Se, Te) semiconductors from first-principles investigation

    Materials Science in Semiconductor Processing · 2024-06-18

    Muhammad Salman Khan, Banat Gul, Abdelhay Salah Mohamed, Ghlamallah Benabdellah, Gulzar Khan, Bashir Ahmad, Hijaz Ahmad, Md Khalid Auranzeb

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  16. Exploring the physical properties of novel ACu3S3 (A = Sc, Y) semiconductors via first-principles calculation

    Materials Science in Semiconductor Processing · 2024-07-10

    Muhammad Salman Khan, Banat Gul, Gulzar Khan, Ghlamallah Benabdellah, Bashir Ahmad, Bashir Ahmad, Munirah D. Albaqami, Saikh Mohammad, Md Khalid Auranzeb, Hijaz Ahmad

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  17. Study of the electronic, magnetic, and thermoelectric aspects of spinel chalcogenides SrCe 2 Z 4 (Z = Te, Se, S) for spintronic and energy applications

    RSC Advances · 2025-01-01

    Muhammad Furqan, Ghulam M. Mustafa, Hanof Dawas Alkhaldi, Fawziah Alhajri, G. I. Ameereh, Murefah mana Al‐Anazy, Ali El‐Rayyes, Qasim Mahmood

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  18. NiVX (X=Si & Ge) Heuslerene: A ferromagnetic semiconductor for thermoelectric and spintronics applications through DFT study

    Journal of Physics and Chemistry of Solids · 2025-01-13

    S. Monika, G. Suganya, G. Kalpana

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  19. Spin-polarized analysis of ferromagnetism, optoelectronic and transport characteristics of HgGd2(S/Se)4 spinels: DFT-calculations

    Materials Today Communications · 2025-01-19

    M. Ammar Yasir, Naveed Ahmad Noor, Muhammad Aslam Khan, Shanawer Niaz, Sohail Mumtaz, Ihab Mohamed Moussa, Hamid Ullah

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  20. Electronic, magnetic, thermoelectric and optoelectronic properties of CaPr2(S/Se)4 for spintronic and energy applications

    Journal of Rare Earths · 2025-04-11

    Muhammad Rashid, A. Qadoos, Hanof Dawas Alkhaldi, Imed Boukhris, Qasim Mahmood, Murefah mana Al‐Anazy, Zhenyi Jiang

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  21. Thermoelectric Performance of SnMg2O4 Spinel Oxide for Energy Applications

    Chemistry Africa · 2025-08-28

    R. K. Karthika, Vipul Srivastava

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  22. Investigation of Curie temperature, magnetic, and transport aspects of CaEr2(S/Se)4 chalcogenides for spintronic applications

    Journal of Physics and Chemistry of Solids · 2025-10-01

    Muhammad Amin, Mohamed Abdel Rafea, Hala Siddiq, Qasim Mahmood, Omar Zayed, Tariq M. Al-Daraghmeh, Magdi E. A. Zaki, Sobhi M. Gomha

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  23. Exploring the electronic, optical, and thermoelectric properties of novel CsLaMTe3 (M = Cd, Zn) materials for sustainable energy harvesting

    Materials Research Bulletin · 2025-10-23

    Mohannad Mahmoud Ali Al-Hmoud, Banat Gul, Muhammad Salman Khan, Gulzar Khan, Siti Maisarah Aziz, Ashour M. Ahmed

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  24. Discovery of a Compound near Mg 3 Sb 2 in the Mg–Sb–Ni System: The Crystal Structure, Stability, and Thermoelectric Performance

    Inorganic Chemistry · 2026-04-28

    Wanqing Yang, Yu Cai, Jiandi Liu, Guangfeng Zhang, Wei He, Tianhua Ju, Shuohai Fang, Hui Luo, Hongliang Dong, Zhikai Zhu, Changzhong Liao

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  25. Engineering phonon anharmonicity and electronic band convergence in Mg3XY (X = Si, Ge; Y = S, Se, Te) monolayers for high thermoelectric performance

    Physica E Low-dimensional Systems and Nanostructures · 2026-09-02

    Zhonghao Zheng, Haiyu Wang, Zhuoshi Liu, Kai Zheng, Heping Cui, Xianping Chen, Jiabing Yu

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  26. First-principles study of ferromagnetism and thermoelectric aspects of Sr(Pr/Nd)2S4 spinel chalcogenides as promising aspirants for spintronic and energy applications

    Journal of Molecular Graphics and Modelling · 2026-09-15

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  27. Antiferromagnetic semiconductor SrGd2X4 (X = S/Se) as a promising multifunctional material for photocatalytic hydrogen generation and energy harvesting: A first-principles study

    Surfaces and Interfaces · 2026-09-21

    Jaffer Saddique, Saba Mubashar, Rabia Iqbal, Ihab Mohamed Moussa, Khunsa Iftikhar, Yanfang Ji

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