[Wien] About effective mass in BoltzTraP ?

xin luo zhongshanluo at yahoo.com.cn
Tue Jun 10 17:07:09 CEST 2008


Dear Georg Madsen:
  I want to calculate the effective mass of insulater, the second derivative of the 
electron energy. I didn't find any instruction in the user guide of BoltzTraP.  Where can i find the calculated effective mass in BoltzTraP? 
  for example, how to calculated the effective mass at gamma in the Test case: CoSb3
   
  #       Ef     T [K]            N         DOS(Ef)           S             s/t               R_H        kappa0         c                 chi
   0.43321   50.0000     32.53884458  0.47303390E+03  0.11236149E-05  0.13259595E+21  0.28045809E-09  0.15756624E+15  0.20558762E+01  0.70619908E-08
  …… …… …… …… …… ……

  where can we find it from the above calculated CoSb3.trace file? 

   


Yours sincerely,
 
Luo Xin 
 
State Key Laboratory of Optoelectronic Materials and Technologies/Institute 
of Optoelectronic and Functional Composite Materials, 
School of Physics and Engineering, 
Sun Yat-sen University, 
Guangzhou, China, 510275
 
mobile phone:13760890587

       
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