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Consider the transition dipole matrix element for the vibrational part of a ro-vibrational transition of a polyatomic molecule. From a group theory point.

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Presentation on theme: "Consider the transition dipole matrix element for the vibrational part of a ro-vibrational transition of a polyatomic molecule. From a group theory point."— Presentation transcript:

1 Consider the transition dipole matrix element for the vibrational part of a ro-vibrational transition of a polyatomic molecule. From a group theory point of view, what is the selection rule expressed through this integral? (A) Levels j and k must belong to the same irrep. (B) Levels j and k must belong to different irreps. (C) The direct product of the symmetries of levels j and k must transform like x, y or z. (D) The direct product of the symmetries of levels j and k must contain the totally symmetric irrep of the point group. (E) Level j or level k must be totally symmetric.

2 Consider the transition dipole matrix element for the vibrational part of a ro-vibrational transition of a polyatomic molecule. From a group theory point of view, what is the selection rule expressed through this integral? (A) Levels j and k must belong to the same irrep. (B) Levels j and k must belong to different irreps. (C) The direct product of the symmetries of levels j and k must transform like x, y or z. (D) The direct product of the symmetries of levels j and k must contain the totally symmetric irrep of the point group. (E) Level j or level k must be totally symmetric.

3 Consider the situations sketched below, where the electric dipole moment and the polarizability are plotted as a function of the normal coordinate for three different vibrations. Which ones are IR/Raman active? (A) IR: II and III; Raman: II and III (B) IR: I and II; Raman: II and III (C) IR: I; Raman: II and III (D) IR: II and III; Raman: I (E) IR: none; Raman: all I II III

4 Consider the situations sketched below, where the electric dipole moment and the polarizability are plotted as a function of the normal coordinate for three different vibrations. Which ones are IR/Raman active? (A) IR: II and III; Raman: II and III (B) IR: I and II; Raman: II and III (C) IR: I; Raman: II and III (D) IR: II and III; Raman: I it’s CO2 explanations on right (E) IR: none; Raman: all I II III


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