Questions tagged [vibrational-spectroscopy]

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PE expression for vibrational spectra of molecules using Newton's second law

I am currently studying the textbook Infrared and Raman Spectroscopy: Principles and Spectral Interpretation, second edition, by Peter J. Larkin. Section 10. Calculating the Vibrational Spectra of ...
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$Q_3$ is symmetric with respect to the $\sigma_v$ operation?

I am currently studying the textbook Infrared and Raman Spectroscopy: Principles and Spectral Interpretation, second edition, by Peter J. Larkin. Section 8. Symmetry: Infrared and Raman Active ...
2
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50 views

What is the precise meaning of “in-phase” (and “out-of-phase”) in this context?

I am currently studying the textbook Infrared and Raman Spectroscopy, 2nd edition, by Peter Larkin. In a section entitled Symmetry: Infrared and Raman Active Vibrations, the author says the following: ...
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1answer
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Raman scattering and “electron and proton center” of molecule

I am currently studying the textbook Infrared and Raman Spectroscopy, 2nd edition, by Peter Larkin. In a section entitled The Raman Scattering Process, the author says the following: Light scattering ...
2
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0answers
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What are the alternatives we have to the VEDA 4 vibrational energy distribution analysis software?

Said software is very useful when you need to assign the peaks in vibrational spectra to different vibrational modes found in a hessian calculation for a given molecule, as described in Jamróz, Michał ...
2
votes
1answer
50 views

Frequency region and “uncoupled oscillators” in vibrational spectroscopy

I am currently studying the textbook Infrared and Raman Spectroscopy by Larkin. In the first chapter of the textbook, the author presents the following table and accompanying explanation: The ...