Jun 25, 2019   12:03 p.m. Tadeáš
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Course syllabus 445K0_4D - Quantum Theory of Molecules (FCFT - 2018/2019 - post-graduate studies)


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University: Slovak University of Technology in Bratislava
Faculty: Faculty of Chemical and Food Technology
Course unit code: 445K0_4D
Course unit title: Quantum Theory of Molecules
Mode of completion and Number of ECTS credits: Exam-PhD (6 credits)
Course contents:
1.Methods (allowance 10/0)
 
a.Ab initio and semiempirical methods
b.Correlation energy and CI
c.DFT methods
d.Adiabatic potential surface and molecular structure

2.Applications (allowance 14/0)
 
a.AO bases
b.Spectra interpretation
c.Population analysis
d.Software use


Last modification made by Ing. Tomáš Molnár on 08/27/2018.

Type of output: