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收藏Exploring stability, mechanical, electronic, magnetic, thermoelectric, and thermodynamic properties of double perovskite Ba2PmSbO6: A first-principles investigation探索双钙钛矿Ba₂PmSbO₆的稳定性、力学、电子、磁性、热电和热力学性质:第一性原理研究
Abbassia, Henni; Caid, Messaoud; Rached, Djamel; Deligoz, Engin; Rached, Habib; Mansour, Houda; Ozisik, Haci; Elahmar, Mohamed Hichem; Mahmoud, Nada Talal
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收藏First-principles calculations to investigate structural, elastic, electronic, magnetic, and optical properties of half-Heusler alloys RhVZ (Z = Bi, Te, Tl): using GGA and TB-mBJ potentials基于第一性原理计算研究半赫斯勒合金RhVZ(Z = Bi, Te, Tl)的结构、弹性、电子、磁性和光学性质:采用GGA和TB-mBJ势能
Bahlouli, A.; Arar, R.; Bachiri, M.; Caid, M.; Rached, D.; Rached, H.; Mansour, H.; Rached, Y.
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收藏Computational Design of M4GaC3 (M = V, Nb, Ta) MAX-Phases: Stability, Mechanical Strength, and Optical Response Under High Pressure and TemperatureM4GaC3(M = V, Nb, Ta)MAX相的计算设计:高压和高温下的稳定性、力学强度及光学响应
Ouadha, I.; Elahmar, M. H.; Rached, H.; Caid, M.; Rached, D.; Rached, Y.; Al-Qaisi, S.; Boutramine, A.; Hacini, N.
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收藏Exploring the multifunctional potential of lead-free Na2LiTlZ6 (Z = Br, Cl) perovskites: a first-principles study of their photovoltaic and thermoelectric behavior探索无铅Na2LiTlZ6 (Z = Br, Cl)钙钛矿的多功能潜力:对其光伏和热电行为的第一性原理研究
Hammad, T. R.; Al-Qaisi, Samah; Algethami, Norah; Boutramine, Abderrazak; Alzahrani, Hind Saeed; Alfaifi, Amani H.; Ali, Malak Azmat; Rehman, Javed; Zaman, Abid; Rached, Habib
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收藏First-principles investigation of K2InSbZ6 (Z= I, Br, Cl, F) eco-friendly halide double perovskites: Structural, thermodynamic, optoelectronic, and thermoelectric properties for efficient energy harvesting applications基于第一性原理的K2InSbZ6 (Z= I, Br, Cl, F)环保卤化物双钙钛矿研究:结构、热力学、光电及热电性质及其在高效能量收集应用中的研究
Boutramine, Abderrazak; Al-Qaisi, Samah; Algethami, Norah; Tastift, Salima; Alfaifi, Amani H.; Alzahrani, Hind Saeed; Chaib, Hassan; Jappor, Hamad Rahman; Rached, Habib
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收藏DFT Insights Into the Structural, Stability, Elastic, and Optoelectronic Characteristics of Na2LiZF6 (Z = Ir and Rh) Double Perovskites for Sustainable Energy
Es-Smairi, Adil; Al-Qaisi, Samah; Sfina, N.; Boutramine, Abderrazak; Jappor, Hamad Rahman; Alzahrani, Hind Saeed; Alfaifi, Amani H.; Rached, Habib; Verma, Ajay Singh; Archi, Marouane; Rahman, Md. Ferdous
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收藏Future Insights into Double Perovskites Ba2AlTMO6 (TM = W, Re, and Os) for Sustainable and Clean Energy Production: A DFT Investigation Using GGA, TB-mBJ, and HSE06 Methods
Rached, H.; Rached, D.; Caid, M.; Amrani, L.; Rached, Y.; Mansour, H.; Mahmoud, N. T.; Al-Qaisi, S.; Alyami, M.; Belkacem, A. A. Ait
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