Oct 17, 2019   9:44 a.m. Hedviga
Academic information system

Course syllabus N400K3_4D - Advanced Quantum Chemistry of Atoms, Molecules and Condensed Systems (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: N400K3_4D
Course unit title: Advanced Quantum Chemistry of Atoms, Molecules and Condensed Systems
Mode of delivery, planned learning activities and teaching methods:
lecture5 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 students to work with advanced quantum chemistry methods at post Hartree-Fock level.
 
Course contents:
Second quantization. Standard models. Bases of atomic functions. Short-range interactions and orbital expansions. Evaluation of molecular integrals. Hartree-Fock theory. CI theory. MCSCF method. Coupled cluster theory. Perturbation theory. Calibration of electron structure models.
 
Recommended or required reading:
 
Language of instruction: slovak or english
 
Notes:
 
Courses evaluation:
Assessed students in total: 2

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


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

Type of output: