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RESEARCH PAPER · Computational Condensed Matter · 2019

First principle study of structural, electronic, optical and electric properties of Ag2ZnGeX4(S, Se)

Fatimazahra Nainaa, Naoual Bekkioui, Abderrahman Abbassi, Hamid Ez-zahraouy A

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First principle study of structural, electronic, optical and electric properties of Ag2ZnGeX4(S, Se)OriginalElectronic and optical properties of quaternary sulfide Tl2HgSnS4, a promising optoelectronic semiconductor: A combined experimental and theoretical study15Ab initio prediction of the elastic, electronic and optical properties of a new family of diamond-like semiconductors, Li2HgMS4 (M = Si, Ge and Sn)34Structural, optical and electronic properties of ZnAg2GeTe4 and ZnAg2Ge0.93Fe0.07Te4 photocatalyst: a first principle approach9DFT study of structural, electronic, and thermoelectric properties of Cs2PdX(X=Br2Be2Te2) compound20Predicting the structural, optoelectronic, dynamical stability and transport properties of Boron-doped CaTiO 3 : DFT based study19Structural features of Cu2MgxZn1−xSnS4 solid solution films for third-generation solar cells4First principles investigations for structural, electronic, optical and elastic properties of Ag2BeSn(S/Se)4 chalcogenide in kesterite and stannite phases with theoretical SLME calculations10Photovoltaic and thermoelectric properties of Ag2MnGeS4_Kesterite: First-principal investigations0Thermoelectric Characteristics of Silver-Based Chalcopyrite Semiconductors: An Ab Initio Study Based on the Nonempirical Range-Separated Dielectric-Dependent Hybrid4

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  1. Electronic and optical properties of quaternary sulfide Tl2HgSnS4, a promising optoelectronic semiconductor: A combined experimental and theoretical study

    Optical Materials · 2019-04-28

    Anatoliy A. Lavrentyev, B.V. Gabrelian, Tuan V. Vu, L.N. Ananchenko, G.L. Myronchuk, O. V. Parasyuk, V.A. Tkach, K.I. Kopylova, Oleg Yu Khyzhun

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  2. Ab initio prediction of the elastic, electronic and optical properties of a new family of diamond-like semiconductors, Li2HgMS4 (M = Si, Ge and Sn)

    Journal of Alloys and Compounds · 2020-06-10

    S. Alnujaim, Abdelmadjid Bouhemadou, Abdelhak Bedjaoui, Saad Bin-Omran, Yarub Al-Douri, R. Khenata, Said Maabed

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  3. Structural, optical and electronic properties of ZnAg2GeTe4 and ZnAg2Ge0.93Fe0.07Te4 photocatalyst: a first principle approach

    Molecular Simulation · 2021-01-12

    Md. Mahmud Hasan, Ajoy Kumer, Unesco Chakma, Md. Tawhidul Islam

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  4. DFT study of structural, electronic, and thermoelectric properties of Cs2PdX(X=Br2Be2Te2) compound

    Computational Condensed Matter · 2021-10-02

    Amina Boubekraoui, Hajar Moatassim, Ahmed Al-Shami, Hamid Ez-zahraouy A

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  5. Predicting the structural, optoelectronic, dynamical stability and transport properties of Boron-doped CaTiO 3 : DFT based study

    Physica Scripta · 2022-10-07

    Loubaba Attou, Ahmed Al-Shami, B. Jaber, O. Mounkachi, Hamid Ez-zahraouy A

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  6. Structural features of Cu2MgxZn1−xSnS4 solid solution films for third-generation solar cells

    Journal of Alloys and Compounds · 2022-11-16

    Maksym Yermakov, Roman Pshenychnyi, Anatoliy Opanasyuk, Yu. P. Gnatenko, Oleksii Volodymyrovych Klymov, C. Martínez‐Tomás, Vicente Muñoz-Sanjosé

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  7. First principles investigations for structural, electronic, optical and elastic properties of Ag2BeSn(S/Se)4 chalcogenide in kesterite and stannite phases with theoretical SLME calculations

    Physica B Condensed Matter · 2022-12-08

    Ashutosh K. Srivastava, Arun Mannodi‐Kanakkithodi, Trupti Ranjan Lenka, Gopinath Palai, Susanta Kumar Tripathy

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  8. Photovoltaic and thermoelectric properties of Ag2MnGeS4_Kesterite: First-principal investigations

    Optik · 2023-07-06

    Fatimazahra Nainaa, Houda Jebari, Naoual Bekkioui, Hamid Ez-zahraouy A

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  9. Thermoelectric Characteristics of Silver-Based Chalcopyrite Semiconductors: An Ab Initio Study Based on the Nonempirical Range-Separated Dielectric-Dependent Hybrid

    The Journal of Physical Chemistry C · 2025-02-12

    Dimple Rani, Subrata Jana, Manish K. Niranjan, Prasanjit Samal

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