[Pw_forum] Wannier BandStructure
giovanni.pizzi at epfl.ch
Wed Jul 23 19:37:52 CEST 2014
for Wannier90-related questions, please use the dedicated mailing list
as explained here:
For your question, I suggest that you first check the most updated
(should be example 11) together with the example files in the examples/
subfolder of the Wannier90 package.
This should probably help you solving your problem (most probably you
just defined the kpoint_path block, but did not write anything in it -
in case of doubt, see also the very exhaustive documentation
If you still encounter problems, please post any further question on the
Wannier mailing list.
Post-doctoral Research Scientist
EPFL STI IMX THEOS
MXC 340 (Bâtiment MXC)
CH-1015 Lausanne (Switzerland)
Phone: +41 21 69 31124
On 07/23/2014 07:18 PM, Tommaso Francese wrote:
> Dear all Wannier Users,
> i'm beginner with Wannier90 computational method. So, it might be a
> stupid question, but when i try to follow the
> http://www.wannier.org/cecam07/tutorial_cecam.pdf, i'm able to do the
> first part (Silicon Valence Bands), until the XcrysDen file
> generation; but the next (Valence + Conduction State), following the
> tutorial fails, and the silicon.werr warns me as follow:
> Wannier90: Execution started on 23Jul2014 at 19:08:27
> A bandstructure plot has been requested but there is no kpoint_path block
> Can you help me?
> I added the two strings as suggested in the tutorial, but it doesn't work.
> Thanks in advance for every tips,
> Università Cà Foscari di Venezia
> Pw_forum mailing list
> Pw_forum at pwscf.org
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