Skip to Content.
Sympa Menu

forum - Re: [abinit-forum] energy bands reader tool

forum@abinit.org

Subject: The ABINIT Users Mailing List ( CLOSED )

List archive

Re: [abinit-forum] energy bands reader tool


Chronological Thread 
  • From: Masayoshi Mikami <mmikami@rc.m-kagaku.co.jp>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] energy bands reader tool
  • Date: Thu, 7 Jul 2005 18:42:23 +0900

Dear Dr. Ersen Mete,

Hello, "Gun aydin."
I just tried it for Tutorial #3 (t35.out) to see what happen,
and found your f90 code useful for quick check of calculation results
(if one does not install Matlab or something on his/her machine;
if so, http://www.abinit.org/developers/?text=matlab).

As a memo for beginners (now, the forum ML subscribers have got 630 !),
I leave what I did; compile ebands.f90, run "ebands",
then type an output file (*.out) to be read, then *.bnd/*.plt were made.
In gnuplot, type 'load "blah.plt" '. then the data file "blah.bnd" will be
plotted with color lines: N.B. "blah" corresponds to the part of the output.

Great. "Ne guzel !"
Thank you ("Tesekkur ederim") for your contribution !

Kind regards,
Masayoshi

P.S. for new subscribers, the shared web is here:
http://www.abinit.org/wws/d_read/forum/

On 2005/07/03, at 6:49, emete@balikesir.edu.tr wrote:

I uploaded a small script into shared web folder.
It extracts the energy bands from a proper output file.
It works for me i hope it will ease your work too.





Archive powered by MHonArc 2.6.16.

Top of Page