Dear Andrea,<div><br></div><div>Thank you very much! Owning to your help, I have got a perfect bands diagram without abnormal lines. Your instruction plays a significant role in curbing this problem. Many thanks!</div><div>
<br></div><div>Yuewen Fang<br><br><div class="gmail_quote">2012/9/4 Andrea Dal Corso <span dir="ltr"><<a href="mailto:dalcorso@sissa.it" target="_blank">dalcorso@sissa.it</a>></span><br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
Now use plotband.x on bands-down-lsym.dat. Plotband.x reads also<br>
the .rap file and produces several files that you can plot with<br>
a graphical program.<br>
<span class="HOEnZb"><font color="#888888"><br>
Andrea<br>
</font></span><div class="HOEnZb"><div class="h5"><br>
<br>
On Tue, 2012-09-04 at 20:12 +0800, Yue-Wen Fang wrote:<br>
> I have use this way you said before, but just got two files<br>
> name bands-down-lsym.dat.rap and bands-down-lsym.dat.<br>
> What's more this flag lsym=.true. costs much more time in computing<br>
> obviously with 4 processors.<br>
><br>
> PID USER PR NI VIRT RES SHR S %CPU %MEM TIME+ COMMAND<br>
><br>
> 2800 fyw 16 0 77416 33m 3332 R 89.9 0.2 5:53.96 bands.x<br>
><br>
> 2834 fyw 16 0 76864 33m 3092 R 89.6 0.2 5:46.15 bands.x<br>
><br>
> 2863 fyw 16 0 76344 33m 3092 R 89.6 0.2 5:48.02 bands.x<br>
><br>
> 2805 fyw 16 0 76992 33m 3092 R 86.9 0.2 5:34.04 bands.x<br>
><br>
> 2012/9/4 Andrea Dal Corso <<a href="mailto:dalcorso@sissa.it">dalcorso@sissa.it</a>><br>
> You can try the flag lsym=.true. as input of bands.x and plot<br>
> all the<br>
> files that are produced by plotband.x.<br>
><br>
> HTH,<br>
><br>
> Andrea<br>
><br>
> On Tue, 2012-09-04 at 18:04 +0800, Yue-Wen Fang wrote:<br>
> > Dear all,<br>
> ><br>
> ><br>
> > I plotted a bands diagram with plotband.x, but there is some<br>
> chaos in<br>
> > the diagram (namely the output file <a href="http://bands.ps" target="_blank">bands.ps</a>). The diagram<br>
> was put in<br>
> > the this website:<br>
> <a href="http://www.douban.com/group/topic/32502443/" target="_blank">http://www.douban.com/group/topic/32502443/</a><br>
> > I also tried to save the bands.xmgr as bands.dat and load it<br>
> to<br>
> > origin 8.0 and Xmgrace, but all failed. The problem still<br>
> emerged.<br>
> > How to fix this program and curb the problem?<br>
> ><br>
> ><br>
> > Best Regards!<br>
> ><br>
> ><br>
> > --<br>
> > ----<br>
> > Yue-Wen Fang<br>
> ><br>
> ><br>
> ><br>
> ><br>
> ><br>
><br>
> > _______________________________________________<br>
> > Pw_forum mailing list<br>
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> --<br>
> Andrea Dal Corso Tel. 0039-040-3787428<br>
> SISSA, Via Bonomea 265 Fax. 0039-040-3787249<br>
> I-34136 Trieste (Italy) e-mail: <a href="mailto:dalcorso@sissa.it">dalcorso@sissa.it</a><br>
><br>
><br>
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><br>
><br>
><br>
><br>
> --<br>
> ----<br>
> Yue-Wen Fang<br>
><br>
><br>
><br>
><br>
><br>
><br>
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--<br>
Andrea Dal Corso Tel. 0039-040-3787428<br>
SISSA, Via Bonomea 265 Fax. 0039-040-3787249<br>
I-34136 Trieste (Italy) e-mail: <a href="mailto:dalcorso@sissa.it">dalcorso@sissa.it</a><br>
<br>
<br>
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</div></div></blockquote></div><br><br clear="all"><div><br></div>-- <br>----<div>Yue-Wen Fang</div><div><br></div><div><br></div><br>
</div>