[Wien] BoltzTraP : Problem

Ali ALLAM ali.allam2 at hotmail.com
Mon Oct 29 14:29:50 CET 2012



Dear Wien2k users
I am PhD student
I work on wien2k and BoltzTraP codes
My problem is how to extract the value of the seebeck coefficient versus the Temperature
My input is :
WIEN0 0 0 0.00.814 0.0005 0.1 712CALC3BOLTZ0.151000. 50.-1HISTO
In the file case.trace, i obtain different value of fermi energy at different Temperatures and at different carrier concentrations
Thus, which seebeck coefficient i choose ? (the carrier concentartion varies at the same time with the fermi enegy and the temperature)
With my best regards
Ali ALLAMAix Marseille universityPhD - Physics of materialsMarseille 13013 - FRANCE 		 	   		  
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