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Иш: First-principles investigation of structural, electronic, mechanical, and optical properties of Tl-based halide perovskites (TlXF3; X = Ti, Zr) for reflective coating applications

  1. Cesium Enhances Long-Term Stability of Lead Bromide Perovskite-Based Solar Cells

    Michael Kulbak, Satyajit Gupta, Nir Kedem +4

    Мақола20154 иқтибос
    ABI

  2. Computational Exploration of Structural, Elastic, Optoelectronic and Magnetic Properties of A2YHgCl6 (A = Cs, K) Using Enhanced Computational Techniques

    Kiran Riaz, Nidhal Drissi, Sahar Abdalla +7

    Мақола20254 иқтибос
    ABI

  3. Study of electronic, magnetic, optical and elastic properties of Cu2MnAl a gapless full Heusler compound

    Dibya Prakash Rai, R. K. Thapa

    Мақола20143 иқтибос
    ABI

  4. Phase transition and elasticity of gallium arsenide under pressure

    E. Güler, M. Güler

    Мақола20143 иқтибос
    ABI

  5. First Principle Study of Structural, Electronic, Elastic, and Magnetic Properties of Half-Heusler Compounds ScTiX (X = Si, Ge, Pb, In, Sb, and Tl)

    Nasir Rahman, Mudasser Husain, Juan Yang +9

    Мақола20203 иқтибос
    ABI

  6. Theoretical investigations of double perovskites Rb2YCuX6 (X =Cl, F) for green energy applications: DFT study

    Nasir Rahman, Mudasser Husain, Ahmed Azzouz‐Rached +11

    Мақола20243 иқтибос
    ABI

  7. First principles study on the structural, electronic, mechanical and optical properties of Pb-free double perovskites M2FeMnO6 (M = Rb, Cs)

    Shereen M. Al‐Shomar, Kakul Husain, Aryan Dilawar Khan +8

    МақолаHeusler alloys: electronic and magnetic propertiesInorganic Chemistry Communications20243 иқтибос
    ABI

  8. Exploring Novel Ba2MBiO6 (M = Sm, Tb) Oxide Double Perovskites Employing DFT

    Nourreddine Sfina, Nasir Rahman, Soufyane Belhachi +8

    Мақола20243 иқтибос
    ABI

  9. Investigating structural, optoelectronic, and mechanical properties of novel Tungsten-based oxides double-perovskites compounds Sr2XWO6 (X= Mn, Fe): A DFT approach

    Mudasser Husain, Nasir Rahman, Ahmed Azzouz‐Rached +11

    Мақола20243 иқтибос
    ABI

  10. Exploration of highly correlated Co‐based quaternary Heusler alloys for spintronics and thermoelectric applications

    Ab Quyoom Seh, Dinesh C. Gupta

    Мақола20193 иқтибос
    ABI

  11. DFT-BASED<i>AB INITIO</i>STUDY OF THE ELECTRONIC AND OPTICAL PROPERTIES OF CESIUM BASED FLUORO-PEROVSKITE<font>CsMF</font><sub>3</sub>(<font>M = Ca</font>AND<font>Sr</font>)

    M. Harmel, H. Khachai, M. Ameri +7

    Мақола20123 иқтибос
    ABI

  12. Electronic structure and magnetic properties of quaternary Heusler alloys CoRhMnZ (Z = Al, Ga, Ge and Si) via first-principle calculations

    M. Benkabou, H. Rached, Abdelkader Abdellaoui +6

    Мақола20153 иқтибос
    ABI

  13. Ab initio study of the structural and optoelectronic properties of the half-Heusler CoCr<i>Z</i> (<i>Z</i> = Al, Ga)

    Adda Missoum, T. Seddik, G. Murtaza +6

    Мақола20143 иқтибос
    ABI

  14. Ab initio method of optical investigations of CdS1−Te alloys under quantum dots diameter effect

    Y. Al‐Douri, U. Hashim, R. Khenata +5

    Мақола20153 иқтибос
    ABI

  15. A first principles study on the full-Heusler compound Mn2CuSb

    Xiao‐Ping Wei, Jian-Bo Deng, S. N. G. Chu +4

    Мақола20103 иқтибос
    ABI

  16. <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mi mathvariant="normal">Mn</mml:mi><mml:mn>2</mml:mn></mml:msub><mml:mi mathvariant="normal">Co</mml:mi><mml:mi>Z</mml:mi></mml:mrow></mml:math><mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:mo>(</mml:mo><mml:mi>Z</mml:mi><mml:mo>=</mml:mo><mml:mi mathvariant="normal">Al</mml:mi><mml:mo>,</mml:mo><mml:mi mathvariant="normal">Ga</mml:mi><mml:mo>,</mml:mo><mml:mi mathvariant="normal">In</mml:mi><mml:mo>,</mml:mo><mml:mi mathvariant="normal">Si</mml:mi><mml:mo>,</mml:mo><mml:mi mathvariant="normal">Ge</mml:mi><mml:mo>,</mml:mo><mml:mi mathvariant="normal">Sn</mml:mi><mml:mo>,</mml:mo><mml:mi mathvariant="normal">Sb</mml:mi><mml:mo>)</mml:mo></mml:mrow></mml:math>compounds: Structural, electronic, and magnetic properties

    Gang Liu, Xuefang Dai, H. Y. Liu +4

    Мақола20083 иқтибос
    ABI

  17. Search for half-metallic ferromagnetism in orthorhombic Ce(Fe/Cr)O3 perovskites

    A. Abbad, W. Benstaali, H.A. Bentounes +2

    Мақола20153 иқтибос
    ABI

  18. First principles studies of elastic, electronic and optical properties of chalcopyrite semiconductor ZnSnP2

    Seda Şahin, Y.Ö. Çiftçi, K. Çolakoğlu +1

    Мақола20123 иқтибос
    ABI

  19. First-principles study of four quaternary Heusler alloys ZrMnVZ and ZrCoFeZ (Z = Si, Ge)

    Huan-Huan Xie, Qiang Gao, Lei Li +4

    Мақола20153 иқтибос
    ABI

  20. DFT Insights on the Future Prospects of Ba2PrXO6 (X = Ir, Pt) Double Perovskites for High-Energy Applications

    Nasir Rahman, Khamael M. Abualnaja, Soufyane Belhachi +8

    Мақола20243 иқтибос
    ABI

  21. Full potential calculation of structural, electronic and optical properties of KMgF3

    M. Sahnoun, Mohamed Zbiri, Claude Daul +3

    Мақола20042 иқтибос
    ABI

  22. Doping-dependent thermoelectric properties of BiSb3Te6 from first-principle calculations

    Songke Feng, Shuangming Li, Xin Li +1

    Мақола20142 иқтибос
    ABI

  23. Correlation between the Structural Distortions and Thermoelectric Characteristics in La<sub>1−<i>x</i></sub>A<sub><i>x</i></sub>CoO<sub>3</sub>(A = Ca and Sr)

    Yang Wang, Yu Sui, Peng Ren +4

    Мақола20102 иқтибос
    ABI

  24. Insight into half-metallicity, spin-polarization and mechanical properties of L21 structured MnY2Z (Z= Al, Si, Ga, Ge, Sn, Sb) Heusler alloys

    Saleem Yousuf, Dinesh C. Gupta

    Мақола20172 иқтибос
    ABI

  25. Physical properties of half-metallic AMnO3 (A = Mg, Ca) oxides via ab initio calculations

    B. Amin, Farzana Majid, M. Bilal Saddique +4

    Мақола20182 иқтибос
    ABI