<div dir="ltr">Hello,<br><br>You need to have the other python script (pdos.py) in the working directory in which you are running the get-smearing-pdos.py script. <br>For example in Linux it would be something like:<br>mv pdos.txt pdos.py<br>mv get-smearing-pdos.txt get-smearing-pdos.py<br><pre>python get-smearing-pdos.py ALPHA.pdos BETA.pdos  <br></pre><br>Hopefully that works.<br><br>Regards,<br>Marco<br><br>On Friday, May 9, 2014 5:48:39 PM UTC-4, mohamed khuili wrote:<blockquote class="gmail_quote" style="margin: 0;margin-left: 0.8ex;border-left: 1px #ccc solid;padding-left: 1ex;"><div dir="ltr"><br>Thanks <span><span style="color:rgb(34,34,34)">Marco</span></span> for your reply, <br><span lang="en"><span>I tried with</span> <span>this script,</span> <span>but</span> <span>I do not get</span> <span>the</span> <span>output file '</span><span>smeared.dat</span><span>'. is</span> <span>that</span> <span>this script is</span> <span>available</span> <span>with</span> <span>all versions of</span> <span>cp2k</span><span>? </span>or</span><span lang="en"><span><span lang="en"><span></span> <span>I need</span></span></span><span> to</span> <span>introduce</span> <span>something</span> <span>to</span> <span>the</span></span><span lang="en"></span><span lang="en"> <span>PDOS</span> <span>section</span><br> <span>thank you</span> <span>very much</span></span><br></div></blockquote></div>