[Pw_forum] About diamagnetic calculation
baroni at sissa.it
Tue Sep 26 21:48:06 CEST 2006
may I suggest that you make a step back and answer yourself your own
Are molecular orbitals in diamagnetic materials singly or doubly
hint. here is an excerpts from http://en.wikipedia.org/wiki/Diamagnetism
... Materials that are said to be diamagnetic are those which are
usually considered by non-physicists as "non magnetic" ...
On Sep 26, 2006, at 9:33 AM, Lijun Zhang wrote:
> Dear all,
> I want to perform the phonon calculations of ZnF2, which is
> Should I think of spin polarization?
> Best regards
> Lijun Zhang
> National Lab of Superhard Materials
> Jilin University
> Email: lijun_physics at yahoo.com.cn
Stefano Baroni - SISSA & DEMOCRITOS National Simulation Center -
[+39] 040 3787 406 (tel) -528 (fax) / stefanobaroni (skype)
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