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To enable a smooth and safe start into the semester for all members of the University of Vienna, you can get vaccinated without prior appointment on the Campus of the University of Vienna from Saturday, 18 September, until Monday, 20 September. More information: https://www.univie.ac.at/en/about-us/further-information/coronavirus/.

Warning! The directory is not yet complete and will be amended until the beginning of the term.

270057 SE Molecular Modelling (2019S)

2.00 ECTS (2.00 SWS), SPL 27 - Chemie
Continuous assessment of course work

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).

Details

max. 15 participants
Language: English

Lecturers

Classes

Currently no class schedule is known.

Information

Aims, contents and method of the course

In der LV werden einfache Programmpakete des Molecular Modelling und von Molekülrechnungen vorgestellt. Nach einer Einführung in die Programmpakete Hyperchem, Alchemy und GAUSSIAN wird die Erstellung von Molekülmodellen praktisch geübt und in weiterer Folge molekulare Geometrien und andere Eigenschaften mit einem einfachen ab initio Verfahren berechnet. Abschlossen wird die LV durch die Suche von molekularer Geometrien in verschiedenen Datenbanken.

Assessment and permitted materials

Minimum requirements and assessment criteria

Examination topics

Reading list


Association in the course directory

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

Last modified: Mo 08.04.2019 10:48