[QE-users] plot 1D charge density in quantum espresso

sara akbari akbarisara1537 at gmail.com
Fri Jul 30 21:58:27 CEST 2021


I want to plot 1D charge density along the bond length of silicon and
inserted lithium (Si-Li Line) in a nanowire and use post processing
calculation in quantum espresso. I have questions:
1) For 1D charge density plotting, should i choose iflag=0 or iflag=1 in
input file?
2) Do I have to use the positions of silicon in charge density file  for
x0(1) , x0(2) ,x0(3)?
3) What about e1(1), e1(2) and e1(3)?
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