[Wien] Spin-orbit

Igor R. Shein shein at ihim.uran.ru
Mon Apr 9 08:45:23 CEST 2007


Dear Prof. P Blaha,

I wished to count the test for spin-orbital interaction for metal
Th (as it has been made in Phys. Rev. B, v. 64, p. 153102 (2001)).
I precisely carry out instructions and I create files (Th.inso and 
Th.in1)...
But p1/2 - p3/2 splitting it is impossible. Can be, I not truly do 
something.

Where I am mistaken ?

Yours faithfully,

Igor Shein

-------------- next part --------------
An embedded and charset-unspecified text was scrubbed...
Name: Th.inso
Url: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20070409/8de87a5a/Th.ksh
-------------- next part --------------
An embedded and charset-unspecified text was scrubbed...
Name: Th.in1
Url: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20070409/8de87a5a/Th-0001.ksh


More information about the Wien mailing list