Page 1 of 1

local magnetic moments

Posted: Wed Apr 27, 2005 11:01 am
by mirecek
Hi,
I have a question about magnetic moments on the
individual atoms. How can I extract these from the output
files?

Thanks for answer

local magnetic moments

Posted: Wed Apr 27, 2005 1:51 pm
by admin
They are written in OUTCAR if LORBIT is set appropriately

local magnetic moments

Posted: Tue Feb 01, 2011 7:11 am
by fcossu
What about the version 5.2?
It doesn't work in the same way: i set LORBIT = 11 and i get 0 for every atom. And the magnetization is not null.

local magnetic moments

Posted: Mon Feb 21, 2011 7:54 am
by fcossu
Hi all!
I performed some test calculations in order to see whether the reason I wasn't getting the correct result is system dependent, compiler dependent, or whatever, but i'm still getting zero's in every test, despite the total magnetization is not. Could anyone give me a hint?