We are working on predicted full Heusler compounds and for some of them...we are able to predict them as spintronic.
so far we have not calculated the curie temp..and also since it is predicted compound we are not able to find the experimental data so far. Is it possible to calculate curie temperature with our code. we are calculating the elastic constants at ambient condition for the above mentioned ferromagnetic materials....and still i have the doubt of using the structure file of magnetic or non-magnetic to do so?.... Looking Forward to your response, Best Regards, sundare
_______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html