[Wien] Calculating x kram with intra-band contribution

Chukwuemeka Okoye cmi.okoye at unn.edu.ng
Sun Aug 9 01:25:14 CEST 2020


Dear all,
I am trying to calculate optical properties for a spin polarized
half-metal. x optic, x joint( with both options 6 & 4 as specified)  all
ran smoothly.  Without intra-band i.e 0 in line 3, x kram ran smoothly
also. However, when intra-band contribution is added by using '1' as input
in line  3, x kram failed.
Please, I need assistance to overcome this.
Regards
CMI Okoye


*------------------------------Chukwuemeka M I Okoye*

*Department of Physics and Astronomy,*

*University of Nigeria, *

*Nsukka, Enugu State,*
*Nigeria*
Telephone: +234 7038766990
E-mail: cmi.okoye at unn.edu.ng
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