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Engineering band gaps and thermoelectric properties in Ba2LaXO6 (X = Bi, Sb) double perovskites via first-principles calculations 通过第一性原理计算调控Ba2LaXO6 (X = Bi, Sb)双钙钛矿的能带间隙和热电性质 Ullah, Amir; Alshahrani, M. D.; Alshehri, Salma; Azzouz-Rached, Ahmed; Rahman, Nasir; Husain, Mudasser; Tirth, Vineet; Algahtani, Ali; Rekab-Djabri, Hamza; Elhadi, Muawya; Hussain, Akhlaq 分享 收藏
Electronic and thermo-mechanical behavior of Ni-based intermetallic compounds Ni-based intermetallic compounds的电子和热机械行为 Rahman, Nasir; Ullah, Amir; Azzouz-Rached, Ahmed; Husain, Mudasser; Alshahrani, M. D.; Alshehri, Salma; Albalawi, Hind; Bayhan, Zahra; Almalki, Wafa Mohammed; Elhadi, Muawya; Tirth, Vineet; Rekab-Djabri, Hamza 分享 收藏
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First-Principles Investigation of Structural, Electronic, Mechanical and Optical Properties of Tl Based Semiconducting Perovskites TlVX3 (X = Br, I) for Reflective Coating Applications Amina, Kakul; Husain, Kakul; Alrefaee, Salhah Hamed; Elhadi, Muawya; Abduvalieva, Dilsora; Abiyev, A. S.; Akhter, Naseem; Ahmad, Naveed; Tirth, Vineet; Algahtani, Ali; Hadia, N. M. A.; Zaman, Abid 分享 收藏
Experimental and DFT study of structural, optical and piezoelectric properties of perovskite SmTaO3 for optoelectronic applications Zaman, Abid; Husain, Kakul; Alrefaee, Salhah Hamed; Elhadi, Muawya; Mukhtar, Naila; Al-Qaisi, Samah; Nurmuhammedov, Anvar; Akhter, Naseem; Tirth, Vineet; Algahtani, Ali; Alsuhaibani, Amnah Mohammed; Refat, Moamen S. 分享 收藏
Unveiling the potential of GaPbI3 perovskite: Structural, mechanical, and optoelectronic insights for next-generation solar cells 揭示GaPbI3钙钛矿的潜力: 下一代太阳能电池的结构,机械和光电见解 Harun-Or-Rashid, Md.; Hasan, Kh. Maksudul; Islam, Khandoker Mainul; Onkon, Md Noman Chowdhury; Zishan, Al Shahriar; Elhadi, Muawya; Jany, Md Rafsan; Rashed, Ahmed Nabih Zaki; Islam, Md. Monirul 分享 收藏
Tailoring the structural, elastic, electronic, and optical properties of Cs2ScCuX6 (X = Cl and F) double perovskite compounds via density functional theory (DFT) 通过密度泛函理论 (DFT) 定制Cs2ScCuX6 (X = Cl和F) 双钙钛矿化合物的结构,弹性,电子和光学性质 Ayub, Gohar; Rahman, Nasir; Husain, Mudasser; Sohail, Mohammad; Khan, Rajwali; Sfina, Nourreddine; Elhadi, Muawya; Azzouz-Rached, Ahmed; Alotaibi, Afraa 分享 收藏
Insight into the structural, elastic, optoelectronic, and thermodynamic properties of GaXF3 (X = Se, Si) via density functional theory Tahir, Fareesa Tasneem; Husain, Mudasser; Sfina, Nourreddine; Elhadi, Muawya; Tirth, Vineet; Azzouz-Rached, Ahmed; Alotaibi, Afraa; Khan, Majid; Rahman, Nasir 分享 收藏
Screening the structural, dynamical, and mechanical stability, tuning band gaps, and optical properties of inorganic Cs2RbABr6 (A = Tl and Bi) double perovskites halide using DFT calculations 使用DFT计算筛选无机Cs2RbABr6 (A = Tl和Bi) 双钙钛矿卤化物的结构,动力学和机械稳定性,调谐带隙和光学性质 Husain, Mudasser; Rahman, Nasir; Azzouz-Rached, Ahmed; Tirth, Vineet; Ullah, Hamid; Elhadi, Muawya; Ali, Farooq; Uzair, Muhammad; Alotaibi, Afraa; Humayun, Q.; Ahmad, Rashid; Hussain, Akhlaq; Lu, Jing 分享 收藏
Revealing the Structural, Elastic, Electronic, and Optical Properties of K2ScCuCl6 and K2YCuCl6: An In-Depth Exploration Using Density Functional Theory Shah, Saima Ahmad; Husain, Mudasser; Rahman, Nasir; Sfina, Nourreddine; Elhadi, Muawya; Tirth, Vineet; Alotaibi, Afraa; Khan, Aurangzeb 分享 收藏
Insight into the physical properties of lead-free Chloroperovskites GaXCl3 (X = Be, Ca) compounds: probed by DFT 深入了解无铅氯过氧化物GaXCl3 (X = Be,Ca) 化合物的物理性质: 通过DFT探测 Khan, Zaryab; Khan, Saima Naz; Husain, Mudasser; Rahman, Nasir; Tirth, Vineet; Elhadi, Muawya; Azzouz-Rached, Ahmed; Ullah, Wasi; Uzair, Muhammad; Al-Qaisi, Samah; Khan, Aurangzeb; Alotaibi, Afraa 分享 收藏
First-principle Insight into Structural, Electronic, Optical and Elastic Properties of AgXF3 (Cr, Zr) Halide Perovskite Materials for Application of Reflective Coating Alsuhaibani, Amnah Mohammed; Kamran, Muhammad; Rehman, Fida; Elhadi, Muawya; Khan, Imran; Tirth, Vineet; Abduvalieva, Dilsora; Algahtani, Ali; Refat, Moamen S.; Zaman, Abid 分享 收藏