UFDF039 Quantum Theory of Atoms and Molecules

Faculty of Philosophy and Science in Opava
Summer 2022
Extent and Intensity
0/0/0. 0 credit(s). Type of Completion: dzk.
Guaranteed by
prof. Ing. Ivan Hubač, DrSc.
Centrum interdisciplinárních studií – Faculty of Philosophy and Science in Opava
Course Enrolment Limitations
The course is also offered to the students of the fields other than those the course is directly associated with.
fields of study / plans the course is directly associated with
Course objectives
One-semester course introduces the students to the contemporary state of quantum physics of Atoms and Molecules.
Syllabus
  • - Many-electron wave function
    - Expansioun through Slater determinants
    - Hartree-Fock method
    - Correlation energy
    - Rayleigh-Schrodinger perturbation theory
    - Brillouin-Wigner perturbation theory
    - Cluster expansion of wave function
    - Multireference problem
    - Theory of effective Hamiltonian
Literature
    recommended literature
  • Hubač, I., S.Wilson, S. Brillouin-Wigner Methods for Many Body Systems. Springer, 2010. ISBN 978-90-481-3372-7. info
  • Helgaker, T., Jorgensen, P., Olsen, J. Molecular Electronic-Structure Theory. John Wiley&Sons, 2002. ISBN 0-471-96755-6. info
  • McWeeny, R. Methods of Molecular Quantum Mechanics. Academic Press, 1992. info
  • Fišer, J. Úvod do kvantové chemie. Academia, 1983. info
Language of instruction
Czech
Further comments (probably available only in Czech)
The course can also be completed outside the examination period.
Teacher's information
The attendance at lectures is recommended. It can be substituted by
the self-study of recommended literature and individual consultations.
The course is also listed under the following terms Winter 2009, Summer 2010, Winter 2010, Summer 2011, Winter 2011, Summer 2012, Winter 2012, Summer 2013, Winter 2013, Summer 2014, Winter 2014, Summer 2015, Winter 2015, Summer 2016, Winter 2016, Summer 2017, Winter 2017, Summer 2018, Winter 2018, Summer 2019, Winter 2019, Summer 2020, Winter 2020, Summer 2021, Winter 2021.
  • Enrolment Statistics (recent)
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