Svojstvena stanja energije slobodnih molekula, razdvajanje elektronskih, vibracijskih i rotacijskih stanja za slobodne molekule. Stanja elektronskog i nuklearnog spina. Spektroskopije elektronskih prijelaza- UV/vis, fluorescentna, fotoelektronska spektroskopija. Spektroskopije prijelaza u osnovnom elektronskom stanju - vibracijske spektroskopije, mikrovalna spektroskopija rotacijskih prijelaza. Spektroskopija elektronske paramagnetske rezonancije. Nuklearna magnetska rezonancija. Masena spektrometrija.
Osnove kvantne teorije molekula, Born-Oppenheimerova aproksimacija. Svojstvena stanja energije slobodnih molekula, razdvajanje vibracijskih od rotacijskih stanja za slobodne molekule, analiza oblika vrpci za tekućine. Definiranje simetrije molekula, točkaste grupe, permutacijsko-inverzijske grupe, grupe kristala. Vibracijska analiza normalnim modovima uz interne koordinate za krute molekule. Inverzija i nabiranje prstenova. Primjeri fleksibilnih molekula - nitrometan, ciklobutan, amonijak. Ramanova i infracrvena spektroskopija, izborna pravila opaženih modova. Vibracijska spektroskopija faznih prijelaza, plastični i tekući molekulski kristali. Numeričke metode računanja vibracija - programi gaussian, balga, molvib za slobodne molekule. Dftb+ za račun kristalnih vibracija. Metode molekulske dinamike i račun gustoće stanja u neuređenim sistemima.
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Molecular Physics, Theoretical Principles and Experimental Methods, This book contains description of electronic states of H2+ and H2 molecule; rotation, vibration and potential curves of diatomic molecules with spectra; molecular symmetry and group theory, Wolfgang Demtroder, Wiley VCH, 2005.
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Modern Spectroscopy, J. M. Hollas: Modern spectroscopy, Wiley 2004, J. M. Hollas, Wiley, 2004.
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Molecular Vibrations, indispensable book for anyone solving the vibrational problem of a molecule, E. B. Wilson, J. C. Decious, P. C. Cross, Dover Publications Inc. New York, 1955.
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Introduction to Quantum Mechanics with Applications to Chemistry, fundamental textbook on Schroedinger equation solution for free molecules, Linus Pauling, E. Bright Wilson, Dover Pubications Inc, New York, 1963.
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Basic Principles of Spectroscopy, excellent short textbook covering NMR, NQR, Moessbauer, EPR, microwave, infrared and Raman spectroscopy, electronic, photoluminescence, ORD and circular dichroism, photoelectron spectroscopy, Raymond Chang, International Student Edition, 1971.
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Raman/infrared atlas of organic compounds, this is comprehensive atlas of vibrational spectra, Bernhard Schrader, VCH, 1989.
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Introduction to MagneticResonance, Carrington, A. D. McLachlan: Introduction to MagneticResonance, Chapman&Hall 1983, A. Carrington, A. D. McLachlan, Chapman&Hall, 1983.
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Spin Dynamics: Basics of Nuclear Magnetic Resonance, first few chapters are suitable introduction to nuclear magnetic resonance, M. H. Levitt, Wiley, 2008.
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Molecular Symmetry and Spectroscopy, P. R. Bunker, Per Jensen: Molecular Symmetry and Spectroscopy, NRC Press Ottawa 1998, Philip R. Bunker,Per Jensen, National Research Council of Canada, 1998.
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Vibrational states, this textbook explains in detail how to find redundant coordinates for cyclopropane, among other things, Salvatore Califano, Wiley, 1976.
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Internal rotation and inversion, An introduction to large amplitude motions in molecules, D. G. Lister, J. N. MacDonald, N. L. Owen: Internal rotation and inversion, AcademicPress 1978., David G. Lister, John N. MacDonald, Noel l. Owen, Academic Press, 1978.
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Disorder in Crystals, Chapters 9 and 10 cover disorder in molecular solids, Neville G. Parsonage, Lionel A. K. Stavely, Thomson Litho Ltd, East Kilbride, 1978.
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Far-Infrared Spectroscopy, Chapter 7 is dedicated to skeletal modes of strained-ring systems; Chapter 8 is about torsional motions with periodic potential barriers, Karl Dieter Moeller, Walter G. Rotschield, John Wiley & Sons, 1971.
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Vibration Spectra and Symmetry of Crystals, H. Poulet, J. P. Mathieu, Gordon and Breach, New York, London, Paris, 1976.
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