Investigation on bismuth-based oxide perovskites MBiO3 (M = Rb, Cs, Tl) for structural, electronic, mechanical and thermal properties

被引:0
|
作者
Sajad Ahmad Dar
Malak Azmat Ali
Vipul Srivastava
机构
[1] Govt. Motilal Vigyan Mahavidyalya College,Department of Physics
[2] Govt. Degree College Nowshera,Department of Physics
[3] Government Post Graduate Jahanzeb College Saidu Sharif,Department of Physics
[4] Lovely Professional University,Department of Physics
来源
关键词
Computational Methods;
D O I
暂无
中图分类号
学科分类号
摘要
引用
收藏
相关论文
共 50 条
  • [41] Investigation of structural, opto-electronic, mechanical and thermoelectric properties of Rb- based fluoro-perovskites RbXF3 (X = Rh, Os, Ir) via first-principles calculations
    Khan, Umar Ayaz
    Abdullaha, Mahidur R.
    Sarker, Mahidur R.
    Khan, Naimat Ullah
    Khan, Sajid
    Al-Humaidi, Jehan Y.
    Tirth, Vineet
    Refat, Moamen S.
    Zaman, Abid
    Algahtani, Ali
    Alsuhaibani, Amnah Mohammed
    Ullah, Farhad
    JOURNAL OF SAUDI CHEMICAL SOCIETY, 2023, 27 (03)
  • [42] Insight into the structural, electronic, mechanical and optical properties of inorganic lead bromide perovskite APbBr3 (A = Li, Na, K, Rb, and Cs)
    Bourachid, I.
    Caid, M.
    Cheref, O.
    Rached, D.
    Heireche, H.
    Abidri, B.
    Rached, H.
    Benkhettou, N.
    COMPUTATIONAL CONDENSED MATTER, 2020, 24
  • [43] First principles study of structural stability, electronic structure and mechanical properties of alkali beryllium hydrides ABeH3 (A=K, Rb, Cs)
    Santhosh, M.
    Kanagaprabha, S.
    Rajeswarapalanichamy, R.
    Priyanga, G. Sudha
    Iyakutti, K.
    JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS, 2015, 81 : 34 - 39
  • [44] Structural, mechanical and dynamical stabilities of K2NaMCl6 (M: Cr, Fe) halide perovskites along with electronic and thermal properties
    Abdullah, Danish
    Gupta, Dinesh C.
    JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS, 2023, 569
  • [45] First-principles study of mechanical, electronic structure, optical, thermodynamic properties and hydrogen storage for new hydride perovskites XInH3 (X=Rb, Cs)
    Zhang, Jingyi
    Chen, Shanjun
    Hou, Jie
    Chen, Yan
    Liu, Jin
    Xu, Nanlin
    Song, Ruijie
    Zhang, Weibin
    PHYSICA B-CONDENSED MATTER, 2024, 695
  • [46] Exploring the structural, electronic, optical, mechanical and thermoelectric properties of copper based double perovskites Rb2YCuX6 (X=Br, I)
    Rehman, Fida
    Amina
    Elboughdiri, Noureddine
    Shernazarov, Iskandar
    Quraishi, A. M.
    Mohsen, Q.
    Tirth, Vineet
    Algahtani, Ali
    Alqahtani, Hassan
    Mohammed, Rawaa M.
    Alsuhaibani, Amnah Mohammed
    Refat, Moamen S.
    Hadia, N. M. A.
    Zaman, Abid
    JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS, 2025, 196
  • [47] Evaluation of Structural, Electronic, Optical and Mechanical Properties of Na-based Oxide-Perovskites NaXO3 (X = Co, Be, Ba): A DFT study
    Ruyhan
    Usman, Muhammad
    Bibi, Nazia
    Noreen, Shahzadi
    Alqarni, Areej S.
    Aziz, Asima
    Rahman, Sara
    Aziz, Zabina
    Abbasi, Rabia Ahmad
    MATERIALS TODAY COMMUNICATIONS, 2024, 39
  • [48] The investigation of structural, electronic, optical, and mechanical properties of RGaO3 (R = Ca, Mg) perovskites for optoelectronic applications: A DFT study
    Rehman, Azka
    Tahir, M. B.
    Khan, Nida
    Khalid, N. R.
    Ali, Faisal
    COMPUTATIONAL CONDENSED MATTER, 2022, 33
  • [49] Exploring the structural, electronic, mechanical, magnetic and optical properties of Cs-based hydride-perovskites CsXH3 (X = Cr, Mn) for hydrogen storage application
    Algahtani, Ali
    Liaqat, Maryam
    Amina
    Sajjad, Muhammad
    Quraishi, A. M.
    Kamolova, Nargiza
    Almahri, Albandary
    Elboughdiri, Noureddine
    Ul Haq, Anwar
    Mohammed, Rawaa M.
    Tirth, Vineet
    Hadia, N. M. A.
    Zaman, Abid
    INORGANIC CHEMISTRY COMMUNICATIONS, 2024, 170
  • [50] A comparative study of the structural, mechanical, electronic, and optical properties of lead-free cubic AGeX3 (A = Cs, K, and Rb; X = Cl, Br, and I) perovskites: Insights from DFT simulation
    Asrafusjaman, Md.
    Khatun, Mst. Asma
    Mahfuj, Esheta
    Hasan, Mehedi
    Hossain, A. K. M. Akther
    RESULTS IN PHYSICS, 2024, 57