Solution

ID: past-exam-of-the-chemistry-course-of-the-year-3-of-the-natural-sciences-course-of-the-university-of-cambridge/2022/paper-2a/section-b/24/a/iii/solution

Taking the Hessian of the potential with respect to mass-weighted displacements gives
The equations of motion are , so eigenvalues are squared angular frequencies. Normalized eigenvectors and frequencies are
Both vectors are in the q basis, and . The translation corresponds to equal physical displacements . The stretch has and opposite physical displacements with magnitude ratio . Ordinary frequencies are ; spectroscopic wavenumbers are .
Figure 1.
Original normal mode displacements for free and weakly surface-bound diatomic models
. Details.

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