[Pw_forum] Unit of charge density
Dong-Hee Lim
limkr at umich.edu
Sun Aug 31 06:17:28 CEST 2008
Dear All
I was just wondering what unit of charge density is used in Quantum
Espresso and Xcrysden viewer.
After I calculate a SCF calculation, I got a charge density result
using the following inputs. Xcrysden shows the charge density result
with a legend saying "Scale delta n(r)".
I would appreciate if you let me know how I understand the unit of
charge density.
-----------------------------
&inputpp
prefix = 'input_file'
outdir = '/file_location/,
filplot = 'input_file_charge'
plot_num= 0
/
&plot
iflag = 3
output_format = 5
fileout = 'input_file.dat'
/
-------------------------------------
Thank you,
Donghee
--
Dong-Hee Lim, Ph.D. candidate
Dept. of Civil and Environmental Engineering
University of Michigan
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