[Wien] Optical calculations with spin-orbit

[Chukwuemeka Okoye]

Dear Fred,
 
It is still the same problem that was posted some weeks ago. I had sent the struct file to you. Please the parameters are as follows:
Energy cut-off = -6.0Ry
Rmt*Rkmax =8
Gmax = 14
No of k-points in the IBZ > 10,000
 
I am using Wien2k_02 as well as ifc 6.0 compiler.
 
Thanks for your interest in the problem. 
 
C M I Okoye




Chukwuemeka M. I. Okoye,

Department of Physics and Astronomy,

University of Nigeria,Nsukka,

Enugu State,NIGERIA

234-042-771611

		
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