[Wien] Ferrimagnetic calculation
shamik chakrabarti
shamikphy at gmail.com
Tue Jul 19 15:12:34 CEST 2011
Dear Wien2k users,
We want to do a calculation on [A][B]O4 type
ferrimagnetic material where [A] & [B] are two sublattices having opposite
spin orientations. Now my question is:
Whether we can do this calculation by modifying case.inst file accordingly
(making [A] and [B] spin opposite) and choosing *ferromagnetic calculation*?
OR
We have to go for *antiferromagnetic calculation* and then we should modify
the case.inst file accordingly?
Any response in this regard will be very helpful for us.
with besr regards,
--
Shamik Chakrabarti
Research Scholar
Dept. of Physics & Meteorology
Material Processing & Solid State Ionics Lab
IIT Kharagpur
Kharagpur 721302
INDIA
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20110719/090679b8/attachment.htm>
More information about the Wien
mailing list