Department of Physics and Astronomy

Hands-on Electronic Structure Calculations 2017/2018 (5 credits)

Autumn 2017 weeks 35-43 - 33 % - Campus Cancelled

Application Deadline: 2017-04-18

Enrolment Code: UU-13039 Cancelled

Language of Instruction: English

Location: Uppsala

Selection: Higher education credits in science and engineering

Entry Requirements: 120 credits with Density Functional Theory (DFT) I.

Fees:

If you are not a citizen of a European Union (EU) or European Economic Area (EEA) country, or Switzerland, you are required to pay application or tuition fees. Formal exchange students will be exempted from tuition fees, as well as the application fee. Read more about fees.

Application Fee: SEK 900

Tuition fee, first semester: SEK 12083

Tuition fee, total: SEK 12083

About the course:

To calculate materials specific properties, one needs to solve Kohn-Sham equations in DFT numerically with a handful of different types of basis sets depending on the problem to be solved. With the advent of powerful computers and the development of state-of-the- art electronic structure codes, it is nowadays possible to predict properties even within an accuracy of few meVs. This course will cover basics of different electronic structure methods based on DFT. Sophisticated codes employed nowadays for the calculations of materials-specific properties in physics, chemistry and biology will be demonstrated in the hands-on-session. You will have a very good practical knowledge of quantum mechanical computations of materials properties, which can be directly compared with experiments.

More information

Contact

Department of Physics and Astronomy

Ångströmlaboratoriet, Lägerhyddsvägen 1

Box 516, 751 20 UPPSALA

Telephone: 018-471 5952

Fax: 018-471 5999

Study Counsellor studievagledare@physics.uu.se

Telephone: +46 18 471 35 21