<div dir="ltr">I used 3 input files; the first scf is ok and the second also but the problem always in the third one(
<span style="font-family:"Courier New""><a href="http://avg.in">avg.in</a>). There are CRASH or the calculation run more then 47h without any result.</span><div><br></div><div><p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><u style=""><span lang="EN-US" style="font-family:"Courier New"">File 2:</span></u></p>
<p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><span lang="EN-US" style="font-family:"Courier New""> </span></p>
<p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><span lang="EN-US" style="font-family:"Courier New"">&INPUTPP<br>
prefix = ‘ZnOGaN' ,<br>
outdir = './out/'
,<br>
filplot = 'ZnOGaN.pot'
,<br>
plot_num = 1,<br>
/<br>
</span></p>
<p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><span lang="EN-US" style="font-family:"Courier New""># pp.x < <a href="http://ZnOGaN.pp.in">ZnOGaN.pp.in</a>
> ZnOGaN.pp.o</span><span lang="EN-US" style="font-family:"Courier New"">ut</span></p>
<p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><span lang="EN-US" style="font-family:"Courier New""> </span></p>
<p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><u><span lang="EN-US" style="font-family:"Courier New"">File 3:</span></u></p>
<p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><span lang="EN-US" style="font-family:"Courier New""> </span></p>
<p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><span lang="EN-US" style="font-family:"Courier New"">1<br>
ZnOGaN.pot<br>
1.0<br>
3000<br>
3<br>
2.59<br>
</span></p>
<p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><span lang="EN-US" style="font-family:"Courier New"">#average.x < <a href="http://ZnOGaN.avg.in">ZnOGaN.avg.in</a>
> ZnOGaN.avg.out</span></p><p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><span lang="EN-US" style="font-family:"Courier New""><br></span></p><p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><span lang="EN-US" style="font-family:"Courier New"">I want to have curve like "pot_"</span></p><p class="gmail-MsoPlainText" style="margin:0cm 0cm 0.0001pt;font-family:Consolas"><span lang="EN-US" style="font-family:"Courier New"">Thank you.</span></p></div></div><div id="DAB4FAD8-2DD7-40BB-A1B8-4E2AA1F9FDF2"><br> <table style="border-top:1px solid #d3d4de">
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<a href="#DAB4FAD8-2DD7-40BB-A1B8-4E2AA1F9FDF2" width="1" height="1"></a></div><br><div class="gmail_quote"><div dir="ltr">Le mer. 5 déc. 2018 à 20:44, Stefano Baroni <<a href="mailto:baroni@sissa.it">baroni@sissa.it</a>> a écrit :<br></div><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">How could we? SB<br>
<br>
___<br>
Stefano Baroni, Trieste -- <a href="http://stefano.baroni.me" rel="noreferrer" target="_blank">http://stefano.baroni.me</a><br>
<br>
> On 5 Dec 2018, at 20:34, Nesrine Kouaydi <<a href="mailto:nesrine.akouaydi@gmail.com" target="_blank">nesrine.akouaydi@gmail.com</a>> wrote:<br>
> <br>
> Dear QE users<br>
> <br>
> I am trying to study the planar and macroscopic potentials for heterojunction. I am using average.x but all the time there is error. Can any one help me.<br>
> Thanks in advance.<br>
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