[Materials Square] How to obtain IR/Raman Spectrum of Crystal Structures with Quantum Espresso

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  • Опубліковано 9 січ 2025

КОМЕНТАРІ • 2

  • @JackmaSahil-dj7ei
    @JackmaSahil-dj7ei Рік тому

    Thank you for the Nice method explanation

  • @Rondros503
    @Rondros503 8 місяців тому +1

    Don't use it. I have been trying to calculate Raman spectra for crystals I have measured in real life, but when I compute through their website, it says a Raman doesn't exist. They probably use spectra people have already measured and don't simulate anything.
    The support will not help and ignores the messages.