Showing 21 - 23 results of 23 for search '"DFT calculation"', query time: 0.03s Refine Results
  1. 21
    A new luminescent material based on bismuth(III): Synthesis, structural characterization, DFT calculations, Hirshfeld surface, thermal behavior, vibrational and optical properties

    A new luminescent material based on bismuth(III): Synthesis, structural characterization, DFT calculations, Hirshfeld surface, thermal behavior, vibrational and optical properties by Chaima Jridi, Nour Elleuch, Jerome Lhoste, Mohamed Boujelbene

    Published 2025-01-01
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  2. 22
    Crystal structure, Hirshfeld surfaces analysis, vibrational spectroscopy, thermal behavior, and DFT study of S-triazine perchlorate

    Crystal structure, Hirshfeld surfaces analysis, vibrational spectroscopy, thermal behavior, and DFT study of S-triazine perchlorate by Chaima Zouari, Thameur Dammak, Jerome Lhoste, Mohamed Boujelbene, Mohamed Abdelhedi

    Published 2025-01-01
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  3. 23
    Eu-Substituents-Induced Modifications in the Thermoelectric Properties of the Zintl Phase Ba<sub>1-<i>x</i></sub>Eu<i><sub>x</sub></i>Zn<sub>2</sub>Sb<sub>2</sub> System

    Eu-Substituents-Induced Modifications in the Thermoelectric Properties of the Zintl Phase Ba<sub>1-<i>x</i></sub>Eu<i><sub>x</sub></i>Zn<sub>2</sub>Sb<sub>2</sub> System by Daewon Shim, Junsu Lee, Aziz Ahmed, Ji Hee Pi, Myung-Ho Choi, Kang Min Ok, Kyu Hyoung Lee, Tae-Soo You

    Published 2025-01-01
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