To create a private path for the band structure or the file case.klist_band for any structure we follow the procedure in the following video: We t…
Read moreTo calculate the electronic properties in the real space we use the wannier functions which are the equivalent basis functions of the LAPW functions…
Read more//====================\\ || || || The Woptic Package || …
Read moreINTRODUCTION To learn more about wannier functions click on the following link: https://en.wikipedia.org/wiki/Wannier_function You can chec…
Read moreoptics A collection of .sh and .py scripts to handle files generated by the OPTIC programs within WIEN2k. By Levi Tegg Description WIEN…
Read morewien2plot Plot multiple bandstructures in WIEN2k This code written in Python allows one to plot multiple bandstructure in WIEN2k. The only i…
Read moreTo learn how to study the Si 100 layer saturated with H check the following link: https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg…
Read moreFirst: What's Polarization? For more information check the following link: http://susi.theochem.tuwien.ac.at/reg_user/textbooks/WIEN2…
Read moreHello, my name is Dr Abderrahmane Reggad. I'm a 53 year old and I am a researcher in materials' sciences.
Learn More →