A normal mode of a molecule is a collective vibration in which all atoms oscillate at the same frequency and in phase, along the eigenvector of the mass-weighted Hessian (Proposition 3.3). Each normal mode transforms as an irreducible representation of the point group.
Examples
Example 5.15 (Water)
in , molecule in the plane. Atoms left in place: 3, 1, 3, 1; : ; so . The reduction gives . Translations and rotations removed: . The two modes are the symmetric stretch () and the bend (); the mode is the antisymmetric stretch ().
Example 5.16 (Four more molecules)
The same procedure (computed and checked in the figure data of this chapter) gives:
| molecule | group | modes | |
|---|---|---|---|
| 6 | |||
| 9 | |||
| (via ) | () | 4 | |
| 6 | |||
| 9 | |||
| 15 |
For a linear molecule the infinite group is replaced by its subgroup , in which the degenerate bend splits into .