Re: [Wien] Momentum matrix elements between certain bands along a path

You could use ‘x findbands’ to get the band numbers corresponding to an energy range (in eV). Elias On 11/03/2016 05:16 PM, Yong Woo Kim wrote: > Thank you very much for the reply. It helped me a lot to understand the > data. > > As you have suggested I have tried to "count" the eigenval

[Wien] Query about SOC in WIEN2k

Dear Dr. P. Blaha, I am trying to calculate the magnetic anisotropy energy (MAE) for the magnetic system Nd-metal. For this I tried couple of methods (energy theorem and force theorem) to calculate MAE. Energy theorem: step-1: Performed GGA+U ; Step-2: executed initso_lapw for different directi