apezol

Problem with spin-texture plot

3

Hi, I've been trying to plot the spin texture using pyprocar. I've got some doubts regarding the post-processing. Do I need to use the KPOINT input to calculate the bands?,...

Spin Texture

9

Hello, I've been trying to calculate the spin-texture using mcu. I've followed what Is presented in the page for the MoS2 case but when I try to run my case...

Transport routines within the kubo approach

1

Dear developers, I'm sharing some routines to calculate transport properties using SIESTA and sisl. I'm not sure if this submit is done the properly nor I'm an actual developer, so...

surface green's function in an arbitrary direction

1

Dear developers, I haven't check properly this, but from 'tile' option it seems to me that it's possible to replicate the system's periodicity in any of the three directions given...