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First-principles calculations to investigate physical properties of orthorhombic perovskite YBO3 (B = Ti & Fe) for high energy applications.
RSC Adv. 2023 Jan 31;13(7):4138-4149. doi: 10.1039/d2ra07727b. eCollection 2023 Jan 31.
RSC Adv. 2023.
PMID: 36760284
Free PMC article.
Numerical simulation studies of the new quaternary MAX phase as future engineering applications: The case study of the Nb2ScAC2 (A = Al, Si) compounds.
Azzouz-Rached A, Bendjemai M, Husain M, Bentouaf A, Rekab-Djabri H, Tirth V, Algahtani A, Al-Mughanam T, Alghtani AH, Alrobei H, Elhadi M, Rahman N.
Azzouz-Rached A, et al.
Sci Rep. 2023 Dec 22;13(1):22953. doi: 10.1038/s41598-023-49172-4.
Sci Rep. 2023.
PMID: 38135692
Free PMC article.
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Investigating the Physical Properties of Thallium-Based Ternary TlXF3 (X = Be, Sr) Fluoroperovskite Compounds for Prospective Applications.
Ayub G, Rauf A, Husain M, Algahtani A, Tirth V, Al-Mughanam T, Alghtani AH, Sfina N, Rahman N, Sohail M, Khan R, Azzouz-Rached A, Khan A, Al-Shaalan NH, Alharthi S, Alharthy SA, Amin MA.
Ayub G, et al. Among authors: azzouz rached a.
ACS Omega. 2023 May 9;8(20):17779-17787. doi: 10.1021/acsomega.3c00549. eCollection 2023 May 23.
ACS Omega. 2023.
PMID: 37251136
Free PMC article.
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Appealing perspectives of the structural, electronic, elastic and optical properties of LiRCl3 (R = Be and Mg) halide perovskites: a DFT study.
Rahman N, Husain M, Tirth V, Algahtani A, Alqahtani H, Al-Mughanam T, Alghtani AH, Khan R, Sohail M, Khan AA, Azzouz-Rached A, Khan A.
Rahman N, et al. Among authors: azzouz rached a.
RSC Adv. 2023 Jun 21;13(27):18934-18945. doi: 10.1039/d3ra02640j. eCollection 2023 Jun 15.
RSC Adv. 2023.
PMID: 37350857
Free PMC article.
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Probing the physical properties for prospective high energy applications of QMnF3 (Q = Ga, In) halide perovskites compounds employing the framework of density functional theory.
Tahir FT, Husain M, Sfina N, Rached AA, Khan M, Rahman N.
Tahir FT, et al. Among authors: rached aa.
RSC Adv. 2023 Jun 20;13(27):18788-18798. doi: 10.1039/d3ra02878j. eCollection 2023 Jun 15.
RSC Adv. 2023.
PMID: 37346958
Free PMC article.
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Probing the physical properties of M2LiCeF6 (M = Rb and Cs) double perovskite compounds for prospective high-energy applications employing the DFT framework.
Rahman N, Rauf A, Husain M, Sfina N, Tirth V, Sohail M, Khan R, Azzouz-Rached A, Murtaza G, Khan AA, Khattak SA, Khan A.
Rahman N, et al. Among authors: azzouz rached a.
RSC Adv. 2023 Jun 1;13(23):15457-15466. doi: 10.1039/d3ra01451g. eCollection 2023 May 22.
RSC Adv. 2023.
PMID: 37275204
Free PMC article.
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Correction: Appealing perspectives of the structural, electronic, elastic and optical properties of LiRCl3 (R = Be and Mg) halide perovskites: a DFT study.
Rahman N, Husain M, Tirth V, Algahtani A, Alqahtani H, Al-Mughanam T, Alghtani AH, Khan R, Sohail M, Khan AA, Azzouz-Rached A, Khan A.
Rahman N, et al. Among authors: azzouz rached a.
RSC Adv. 2023 Sep 20;13(40):27964. doi: 10.1039/d3ra90091f. eCollection 2023 Sep 18.
RSC Adv. 2023.
PMID: 37736564
Free PMC article.
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