270142 VO+UE Simulation of Chemical Dynamics (2016W)

Continuous assessment of course work

Moodle

Registration/Deregistration

Note: The time of your registration within the registration period has no effect on the allocation of places (no first come, first served).

Registration is open from We 22.06.2016 08:00 to Fr 30.09.2016 23:59
Deregistration possible until Fr 30.09.2016 23:59

Details

max. 25 participants

Language: German, English

Lecturers

Classes

Erstes Treffen: Dienstag, 11.10.2016, 10h00
PC-Pool theoretischer Chemie, Raum 203, Währingerstr. 17, 1090 Wien

Information

Aims, contents and method of the course

Inhalt:
Zeitabhängige Schrödingergleichung
Wellenpakete
Korrelationsfunktionenen und Spektren
Wechselwirkung zwischen Licht und Materie
Numerische Ansätze
Semiklassische Dynamik
Klassische Molekulardynamik
Statistische Thermodynamik
Hybrid-Ansätze für Dynamik
Ziel:
Verständnis des zeitabhängigen Verlaufs von chemischen Reaktionen auf mikroskopischer Ebene

Content:
Time-dependent Schrödinger equation
Wavepackets
Correlation funkctions and spectra
Interaction of light and matter
Numerical approaches
Semiclassical dynamics
Classical molecular dynamics
Statistical thermodynamics
Hybrid apporaches for dynamics
Goal:
Understanding the time-dependent evolution of chemical reactions on the microscopic scale.

Assessment and permitted materials

Minimum requirements and assessment criteria

Examination topics

Reading list

Association in the course directory

TC-2, EF-1, EF-2, EF-3, Doktorat

Last modified: Mo 07.09.2020 15:41