Oct 15, 2019   1:47 p.m. Terézia
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Course syllabus 421M0_4D - Mathematical Methods of Theoretical Chemistry (FCFT - 2019/2020 - post-graduate studies)


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University: Slovak University of Technology in Bratislava
Faculty: Faculty of Chemical and Food Technology
Course unit code: 421M0_4D
Course unit title: Mathematical Methods of Theoretical Chemistry
Mode of delivery, planned learning activities and teaching methods:
lecture3 hours weekly (on-site method)
seminar2 hours weekly (on-site method)

 
Credits allocated: 6
 
Recommended semester/trimester: Theoretical and Computational Chemistry - doctoral (compulsory), 1. year
Level of study: 3.
Prerequisites for registration: none
 
Assesment methods:
The notation is defined by the currently valid study regulations at the Slovak University of Technology in Bratislava.
 
Learning outcomes of the course unit:
To teach the students the fundamentals of mathematical methods of theoretical chemistry, especially group theory.
 
Course contents:
Linear operators.
Geometry optimizations.
Group theory in chemistry.
 
Recommended or required reading:
Basic:
FIŠER, J. Úvod do molekulové symetrie. Aplikace teorie grup v chemii. Praha : SNTL, 1980. 287 p.
REMKO, M. Molekulové modelovanie: Princípy a aplikácie. Bratislava : SAP-Slovak Academic Press, 2000. 239 p. ISBN 80-88908-62-0.

Recommended:
FIŠER, J. Úvod do kvantové chémie. Praha : Academia, 1983. 247 p.
BREZA, M. Group-Theoretical Analysis of Jahn Teller Systems. In KÖPPEL, H. -- YARKONY, D R. -- BARENTZEN, H. The Jahn-Teller Effect: Fundamentals and Implications for Physics and Chemistry. p. 51--76.
BREZA, M. Group-Theoretical Treatment of Pseudo-Jahn-Teller Systems. In ATANASOV, M. -- DAUL, C. -- TREGENNA-PIGGOTT, P L. Vibronic Interactions and the Jahn-Teller Effect. Heidelberg : Springer, 2012, p. 59--82. ISBN 978-94-007-2383-2.
DIXON, J D. -- MORTIMER, B. Permutations Groups. New York : Springer Verlag London, 1996. 346 p. ISBN 0-387-94599-7.
HUMPHREYS, J F. A Course in Group Theory. New York : Oxford University Press, 2001. 279 p. ISBN 0 19 853459 0.

 
Language of instruction: slovak and english or english
 
Notes:
 
Courses evaluation:
Assessed students in total: 16

PN
100,0 %0 %
Name of lecturer(s): doc. Ing. Martin Breza, CSc. (person responsible for course) - slovak, english
 
Last modification: 20. 5. 2019
Supervisor: doc. Ing. Martin Breza, CSc. and programme supervisor


Last modification made by Ing. Tomáš Molnár on 05/20/2019.

Type of output: