[Wien] density plot pitfall in Quick Start guide
Steven Homolya
steven.homolya at spme.monash.edu.au
Thu Sep 9 08:06:05 CEST 2004
Dear WIEN2k users & developers,
I'm helping a new user get started with WIEN2k. I just spent over an
hour trying to figure out why electron density plots don't work if one
follows the "Quick Start" section of the users' guide.
Problem is the comment only line following this bit of text:
"Edit TiC.in5 choose the offered template input file. To select the
(100) plane for plotting specify the following input:"
With the comment line:
# similar to x,y length
included in TiC.in5, as per instructions in UG, lapw5 crashes. Without
the comment line it works fine. Especially for sake of new users, it
would be good to have this corrected.
Steve
--
Steven Homolya
School of Physics and Materials Engineering
Monash University, VIC 3800
Australia
Tel: +61 3 9905 3646
Fax: +61 3 9905 3637
More information about the Wien
mailing list