Re: [Wien] how to do Spin orbital coupling with hubbard U

Hi, There is nothing wrong in your procedure. It's more a question of choosing the volume for the final calculation U+SOC. One may choose to do no geometry optimization and just use the experimental geometry. If no experimental geometry is available, then you need to calculate it, preferably

[Wien] Is there an effect of SO on the ground state

Dear wien2k users I want to determine the ground state between the non magnetic , ferromagnetic and different antiferromagnetic states and I want to know if the inclusion of spin-orbit coupling affect the ground state or not. Best regards -- Mr: A.Reggad Laboratoire de Génie Physique Université

[Wien] Abstract submission open for International Conference on Advances in Functional Materials-ICAFM2017

Dear colleagues, We cordially invite you to participate in the International Conference on Advances in Functional Materials-ICAFM2017 from January 6th to January 8th, 2017 which will be held in Chennai, India jointly organised by Department of Materials Science, Central University of Tamil Nadu,