Hello Sandeep,

A negative value of U for instance occurs in Ge.

I was given this article before to explain this behavior:

http://www.sbfisica.org.br/bjp/files/v36_286.pdf

Note that the effective U = U-J.


Best regards,

Michael Sluydts

sandeep schreef op 8/07/2015 om 18:49:
Dear users!
It may not be appropriate to post this question here,
"Did any one encounter negative value of U in solids (compounds) ? if so explain its origin and quote related concepts. Kindly explain the origin and experimental supports if any?"



_______________________________________________
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


--
ir. Michael Sluydts
Center for Molecular Modeling
Ghent University
Technologiepark 903
9052 Zwijnaarde, Belgium
tel. +32 (0)9 264 66 19
https://molmod.ugent.be

_______________________________________________
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

Reply via email to