Introduction to WIEN2k

An online training event suitable for new users of the WIEN2k software package. The first part includes a brief overview and background for using WIEN2k. Thereafter, practical examples and discussion of running WIEN2k efficiently on the NSC clusters will be made. The last part of the event will be open for hands-on testing and questions. Note that for the hands-on part you need to be covered by a WIEN2k license and have an account and compute project at NSC.

Registration is not necessary, though if interested to join, I encourage you to contact me beforehand to describe your topics of interest, or if you have some other questions: weiol@nsc.liu.se

Place: Online via Zoom, link sent out via SNIC training newsletter
Time: 13:00 - , Thu Nov 18th, 2021

Tentative Schedule

Tentative schedule, time and exact topics might differ. It will end at latest 17:00, depending on questions and discussion. There will also be some breaks.

13:00 -14:30 Theory and basics
14:30 -15:30 Practical examples
15:30 -17:00 Hands-on and questions

Material

The presentation and example files can be copied from the Tetralith/Sigma folder:

/home/weiol/wien2k_workshop_18Nov2021

The presentation is also available for download as a .pdf. Note that the material might still be a bit rough around the edges since it is the first iteration. Some important missing topics include run_lapw options and typical errors and their solutions.

Contact

Phone: +46 (0)73 461 8948 (Weine Olovsson)
E-mail: weiol@nsc.liu.se