[Pw_forum] plot the wave function for different spin

Carmine Autieri autieri at sa.infn.it
Mon Apr 11 13:53:57 CEST 2011


Dear all, 

I am a phd student an I am new on this forum. I want to know how can I plot the wavefunction in the real space in LSDA.
I found in the forum that I can use 

plot_num = 7
kpoint = 1 (Gamma point if I understood well)
lsign = .true.
kband = band near fermi level

but how can I distingue between up and down spin in LSDA calculation??
On the web site I found 

Options for |psi|^2 (plot_num=7): 
LSDA:  k-point and spin polarization to be plotted
(spin-up and spin-down correspond to different k-points!)

but wich are these different k-points?
 

Thanks
Carmine



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