Structural, electronic, optical, and thermoelectric features of Rb2XSbX’6 (X= Ag, Cu; X’= Cl, Br): Ab-initio calculations

被引:0
|
作者
Bouzidi, M. [1 ]
Ziati, M. [2 ]
Belasfar, K. [2 ]
El Bachiri, A. [1 ]
El Hammoumi, M.M. [1 ]
Rmili, A. [3 ]
Louardi, A. [4 ]
El Kenz, A. [2 ]
Ez-Zahraouy, H. [2 ]
Benyoussef, A. [2 ]
机构
[1] LBGIM Laboratory, Ecole Normale Supérieure, Hassan II University, Casablanca, Morocco
[2] Laboratory of Condensed Matter and Interdisciplinary Sciences, Unité de Recherche Labellisée CNRST, URL-CNRST-17 Faculty of Sciences, Mohammed V University in Rabat, Morocco
[3] Laboratory of Materials Physics and Subatomic, Ibn Tofail University, Kenitra, Morocco
[4] Laboratory of Industrial Techniques, Department of Industrial Engineering, Faculty of Sciences and Techniques, Sidi Mohamed Ben Abdellah University, Fez, Morocco
来源
Optik | 2024年 / 314卷
关键词
37;
D O I
10.1016/j.ijleo.2024.172009
中图分类号
学科分类号
摘要
引用
收藏
相关论文
共 50 条
  • [41] DFT Insight into Structural, Electronic, Optical and Thermoelectric Properties of Eco-Friendly Double Perovskites Rb2GeSnX6 (X = Cl, Br) for Green Energy Generation
    Malak Azmat Ali
    Asma A. Alothman
    Mohammed Mushab
    Afzal Khan
    Muhammad Faizan
    Journal of Inorganic and Organometallic Polymers and Materials, 2023, 33 : 3402 - 3412
  • [42] GEOMETRY OPTIMIZED AB-INITIO CALCULATIONS ON DISUBSTITUTED CYCLOPROPENONES (X2C3O, X=F, CL, OH)
    FITZPATRICK, NJ
    FANNING, MO
    JOURNAL OF MOLECULAR STRUCTURE, 1976, 33 (02) : 257 - 263
  • [43] Optical dispersion functions of Co2-x Eux VSn using ab-initio calculations
    Mahmoud, Nada T.
    Mousa, Ahmad A.
    Juwhari, Hassan K.
    Khalifeh, Jamil M.
    Abu-Jafar, Mohammed S.
    INTERNATIONAL JOURNAL OF MODERN PHYSICS B, 2015, 29 (28):
  • [44] Structure and properties of X(2)O and XYO (X,Y=Cl,Br) molecules: DFT vs 'classical' ab initio calculations
    Chaquin, P
    Bahou, M
    Schriver, A
    Schriver, L
    CHEMICAL PHYSICS LETTERS, 1996, 256 (06) : 609 - 615
  • [45] Infrared spectra of matrix-isolated [OC•••X2] and [CO•••X2] complexes (X = Cl, Br) and ab initio calculations
    Schriver, A
    Schriver-Mazzuoli, L
    Chaquin, P
    Bahou, M
    JOURNAL OF PHYSICAL CHEMISTRY A, 1999, 103 (15): : 2624 - 2631
  • [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] Ab-initio calculations of structural,electronic,and optical properties of Zn3(VO4)2
    Nisar Ahmed
    S Mukhtar
    Wei Gao
    Syed Zafar Ilyas
    Chinese Physics B, 2018, 27 (03) : 224 - 228
  • [48] Ab-initio calculations of structural, electronic, and optical properties of Zn3(VO4)2
    Ahmed, Nisar
    Mukhtar, S.
    Gao, Wei
    Ilyas, Syed Zafar
    CHINESE PHYSICS B, 2018, 27 (03)
  • [49] Ab-initio Study of structural, elastic, electronic and optical properties of hexahalometallate single crystals K2XBr6(X = Se, Pt)
    Naceur, Y.
    Bourbaba, H.
    Ghebouli, M. A.
    Krache, L.
    Ghebouli, B.
    Chihi, T.
    Fatmi, M.
    Alomairy, Sultan
    SCIENTIFIC REPORTS, 2022, 12 (01)
  • [50] Ab-initio Study of structural, elastic, electronic and optical properties of hexahalometallate single crystals K2XBr6(X = Se, Pt)
    Y. Naceur
    H. Bourbaba
    M. A. Ghebouli
    L. Krache
    B. Ghebouli
    T. Chihi
    M. Fatmi
    Sultan Alomairy
    Scientific Reports, 12