[Wien] Lantanium Density of state
NAJMEH SOLTANI
naj23s at yahoo.com
Sat Dec 30 12:22:00 CET 2006
Dear all Wien2k users,
In the file case.int I put La-f states, although in periodic table, the valence states are 5d1/6s2 and I have plot the density of states for LaCrO3. In the density, I have seen a sharp peak for Lantanium f states.Is it correct to put La-f in case.int or not?
I would be glad to recieve your answer.
Regards,
Najmeh
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