Plotting band structures for spin up and spin down
Posted: Tue Aug 27, 2013 9:55 pm
Hello,
I have ran the code and created a NSCF calculation output file. While using AbinitBandStructureMaker.py, it plots the spin up band values (eigenvalues) correctly, but for the life of me, I cannot find out how to plot both the spin up and spin down bands by using AbinitBandStructureMaker.py on the same plot
This is crucial because it is a semiconductor and the spin up band is below the Fermi level while the spin down bands are above the Fermi level (or the HOMO band for spin up and down). I do not want to have to run abinit again to create the spin down, because it is all ready within the output file that has been created.
Can anyone tell me how to plot both spin up and down band structures without having to write my own script. I want them to both exist on an x y plot where you can directly see the overlap and especially the positions of each HOMO band in relation to the Fermi level
I have ran the code and created a NSCF calculation output file. While using AbinitBandStructureMaker.py, it plots the spin up band values (eigenvalues) correctly, but for the life of me, I cannot find out how to plot both the spin up and spin down bands by using AbinitBandStructureMaker.py on the same plot
This is crucial because it is a semiconductor and the spin up band is below the Fermi level while the spin down bands are above the Fermi level (or the HOMO band for spin up and down). I do not want to have to run abinit again to create the spin down, because it is all ready within the output file that has been created.
Can anyone tell me how to plot both spin up and down band structures without having to write my own script. I want them to both exist on an x y plot where you can directly see the overlap and especially the positions of each HOMO band in relation to the Fermi level