Hi, I am trying to calculated charge density corresponding to a given energy range (or alternatively to some specific bands). I have found in the User's Guide some switches such as IBAND and EINT, but when I run the calculation with them, I get no PARCHG files.
Does anyone have any experience with this property? Do I need to compile the code in some special way? I am using VASP4.6.
Thanks in advance!
Band-decomposed charge density
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dholec
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Band-decomposed charge density
Last edited by dholec on Wed Sep 26, 2012 4:35 pm, edited 1 time in total.
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dholec
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Band-decomposed charge density
This was my mistake, I missed the line LPARD=True in the INCAR, thus could not get any desired results. Now all works fine, as described in the UG. David
Last edited by dholec on Thu Sep 27, 2012 8:05 am, edited 1 time in total.