[Wien] Forward of moderated message

[Peter Blaha]

I think I answered this just a few days before:
You must not change the "delta-k" too much, otherwise spaghetti thinks it 
is a new direction which is not connected to the previous one and then 
produces a "gap".

Change the "density of the k-points" in one of the two directions (eg. 
decrease the number of points by a factor of two in the second direction).  




ate: Wed, 8 Oct 2008 13:15:51 +0200
From: "Ludwig, Christian" <ludwigc at uni-mainz.de>
To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at>
Subject: [Wien] white stripe in spaghetti plot

Hi,

there is a white stripe in my spaghetti plot at the gamma point (see 
attached
files). How do I get rid of it? I already tried omitting 0 0 0 or doubling 
it. I
do not get the stripe when I use a template.




                                      P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
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