Skip to Content.
Sympa Menu

forum - Re: why can't i print out the eigenenergies?

forum@abinit.org

Subject: The ABINIT Users Mailing List ( CLOSED )

List archive

Re: why can't i print out the eigenenergies?


Chronological Thread 
  • From: paul.boulanger@umontreal.ca
  • To: forum@abinit.org
  • Subject: Re: why can't i print out the eigenenergies?
  • Date: Wed, 2 May 2007 14:47:34 +0200

Hi,

Could you include your input and output files. It is difficult to understand
your problem without any information on the calculation.

As for drawing the band structure, you can use AbinitBandStructureMaker.py, a
small program written by Benjamin Tardif. It is located in:

ABINIT_DIR/util/users/AbinitBandStructureMaker.py

It is a python program which needs the Numeric librairie, so you need to
write:

> python AbinitBandStructureMaker.py

Their is PDF manual on this program in:

ABINIT_DIR/doc/users/AbinitBandStructureMaker_manual.pdf

Hope this helps,

Paul



Archive powered by MHonArc 2.6.16.

Top of Page