Articles written in Journal of Chemical Sciences
Volume 121 Issue 5 September 2009 pp 811-813
A new scaling algorithm for predicting vibrational spectra of polyatomic molecules
We propose here a relationship between the off-diagonal and diagonal force constants which is valid theoretically under harmonic approximation provided the 𝐿 matrix is available from some theoretical calculation using $L^TFL = \Lambda$.
Volume 135, 2023
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