Universität Wien FIND

Due to the COVID-19 pandemic, changes to courses and exams may be necessary at short notice (e.g. cancellation of on-site teaching and conversion to online exams). Register for courses/exams via u:space, find out about the current status on u:find and on the moodle learning platform. NOTE: Courses where at least one unit is on-site are currently marked "on-site" in u:find.

Further information about on-site teaching and access tests can be found at https://studieren.univie.ac.at/en/info.

270072 UE Modern Quantum Chemistry - Computer Exercises (2017S)

3.00 ECTS (3.00 SWS), SPL 27 - Chemie
Continuous assessment of course work


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


max. 15 participants
Language: English



Preliminary meeting March 7th, 9 a.m., seminar room, ground floor, Währinger Str. 17
Proposed time frame:
Computer exercises on Tuesdays, 10:45 am - 1 pm. Währinger Strasse 17, 2nd floor, PC Pool


Aims, contents and method of the course

Computer exercises for the lecture "Moderne Quantenchemie/Modern Quantum Chemistry"; 1. Mathematical Foundations of Quantum Chemistry; 2. Variational Methods; 3. Born-Oppenheimer Approximation; 4. Hartree-Fock Theory and Basis Sets; 5. Correlation Methods; 6. Density functional theory.

Assessment and permitted materials

Abgabe der Protokolle

Minimum requirements and assessment criteria

Illustrating the fundaments behind ab initio and DFT methods

Examination topics

Reading list

Association in the course directory

TC-2, EF-1, EF-2, EF-3, SHELL-Ergänzungsfach-Chemie, SHELL-Schwerpunkt-Chemie.

Last modified: Mo 07.09.2020 15:41