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Last update: RNDr. Vojtěch Kapsa, CSc. (16.09.2021)
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Last update: doc. Ing. Lucie Augustovičová, Ph.D. (16.09.2021)
Demonstration of the influence of molecular symmetry on the spectra of molecules. |
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Last update: doc. Ing. Lucie Augustovičová, Ph.D. (16.09.2021)
P. R. Bunker, P. Jensen, Molecular Symmetry and Spectroscopy, 2nd ed., Nrc Pubns, 1998.
G. Herzberg, Molecular Spectra and Molecular Structure: Spectra of Diatomic Molecules, 2nd ed. Krieger Pub Co, 1989.
Peter F. Bernath, Spectra of Atoms and Molecules , 2nd ed., Oxford University Press, N.Y., 1995.
Dušan Papoušek, Mamed R. Aliev: Molecular Vibrational-Rotational Spectra, Academia, Prague, 1982. |
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Last update: doc. Ing. Lucie Augustovičová, Ph.D. (16.09.2021)
The exam is oral and the requirements correspond to the syllabus of the subject in the range that was presented at the lecture. |
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Last update: doc. Ing. Lucie Augustovičová, Ph.D. (16.09.2021)
1. Introduction, absorption and emission of radiation, line shape
2. Symmetry of molecules, symmetry operators, point groups
3. Matrix representation, reducible and irreducible representations, character tables
4. Group theory in quantum mechanics, symmetry of the Hamiltonian, use of symmetry in calculation of selection rules and overlap integrals.
5. Atomic spectroscopy, hydrogen atom, multielectron systems, selection rules and transition intensities
6. Pure rotational spectroscopy, rigid and non-rigid rotor, diatomic molecules, symmetric and asymmetric tops, selection rules
7. Vibration of molecules, diatomic and polyatomic molecules, normal modes and their symmetry
8. Vibration-rotation transitions, selection rules and intensities of transitions
9. Electronic spectra of diatomic molecules, vibrational and rotational structure
10. Singlet transitions - Singlet and non-Singlet transitions, Hund's cases
11. Symmetry of energy levels of diatomic molecules, parity e / f, gerade / ungerade, nuclear spin degeneration, s / a parity, line intensities
12. Electronic spectra of polyatomic molecules, molecular orbital, Huckel's theory of MO, vibrational structure, Jahn-Teller and Renner-Teller effect, transition intensities |