[CP2K:5328] Re: plotting PDOS

Marco Olguin synerg... at gmail.com
Tue May 13 18:27:58 UTC 2014

Hey Mohamed,

Sorry I didn't get back to you sooner-  a lot of things came up at once and
things got really busy. I think that you need to add the NLUMO keyword to
the PDOS section of your input file. Try something like the following and
see if it works:

      NLUMO 200


On Tue, May 13, 2014 at 5:59 AM, mohamed khuili <khuili... at gmail.com>wrote:

> I have a question regarding plotting of PDOS obtained from CP2K. When
>>> plotting the data from files containing PDOS the plot looks very sharp. Is
>>> There a code to make spectra look nice, more naturally  and smooth ?
>>> Thank you in advance,
>>> Mohamed
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