The ABINIT Users Mailing List ( CLOSED )

[James Raynolds <JRaynolds@uamail.albany.edu>]

Riad Shaltaf,

        I actually implemented LDOS in my own "personal version" of abinit
in a very dirty manor.  I did it so that I can make STM images and it
worked.  This was about a year ago and I got onto other projects before
cleaning it to so as to be appropriate for submission to abinit.

        Wait 'till you hear from others to see if there is an official
implementation yet.  If not, I can give you mine to use at your own risk.
Incidentally, I do anticipate getting back into the STM image business
shortly since I have a student who wants to work on it.  Perhaps we should
coordinate our efforts...

Sincerely,
Jim Raynolds

-----Original Message-----
From: Riad Shaltaf [mailto:shaltaf@photon.physics.metu.edu.tr]
Sent: Thursday, April 24, 2003 1:05 PM
To: forum@abinit.org
Subject: [abinit-forum] LDOS


Dear abinitors,
Is there any body who knows how to calculate local density of states?
using prtdos we can only have total DOS. i wounder if there is anyway to
calculate or extract it from the diffrent output files.

R. Shaltaf
Department of physics
METU