Oct 21, 2019   3:03 p.m. Uršuľa
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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 title: Advanced Quantum Chemistry of Atoms, Molecules and Condensed Systems
Course unit code: N400K3_4D
Mode of completion and Number of ECTS credits: Exam-PhD (6 credits)
 
Name of lecturer: doc. Ing. Lukáš Bučinský, PhD. (person responsible for course) - slovak, english
 
Learning outcomes of the course unit:
To teach students to work with advanced quantum chemistry methods at post Hartree-Fock level.
 
Prerequisites and co-requisites: none
 
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:
 
Planned learning activities and teaching methods: lecture
 
Assesment methods and criteria: exam
 
Language of instruction: Slovak, English
 
Work placement(s): There is no compulsory work placement in the course unit.


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

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