[Pw_forum] pwcond calculations about the transmission in two seperated spin channels
Erjun Kan
erjunkan at mail.ustc.edu.cn
Sun Mar 15 18:16:48 CET 2009
Dear all,
I want to calculate the transmission of ferromagnetic metal Fe in two spin channels, i.e. spin_up and spin_down seperately.
Iofspin= 2 is used for the calculation, but the calculated results show only the total transmission, such as:
# E-Ef, T
2.950000 1.000000
2.850000 1.000000
2.750000 1.000000
2.650000 1.000000
2.550000 1.000000
2.450000 1.000000
2.350000 1.000000
2.250000 1.000000
2.150000 1.000000
2.050000 1.000000
1.950000 1.000000
1.850000 1.000000
1.750000 1.000000
1.650000 1.000000
1.550000 1.000000
1.450000 1.000000
So anyone have ideas to handle such problem?
Bests,
Erjun Kan
=============================================================
Erjun Kan
Department of Chemistry, North Carolina State University
Raleigh, North Carolina, USA
E-mail: erjunkan at mail.ustc.edu.cn or
ekan at ncsu.edu
=============================================================
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20090315/b6afa8e3/attachment.html>
More information about the users
mailing list