[Wien] different TiC Fermi energy in bandstructure

Donghui Guo dhguo at cat.hokudai.ac.jp
Mon Sep 29 02:31:55 CEST 2008


Dear all,

I calculated the TiC sample and ran tasks to compare the results with usersguide. The results are consistent well to each other excpet for Bandstructure, which has same structure figure but in different Fermi energy. The Fermi energy I calculated is about 0.3 eV higher than that in usersguide. Would you please tell me the reason?
Thank you!

Best regards, 
Yours, 
Donghui Guo
2008-09-29


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Donghui Guo 
Catalysis Research Center (CRC)
Hokkaido University
21-10 Kita, Sapporo 001-0021
Japan
dhguo at cat.hokudai.ac.jp
TEL: +81-11-706 9114 (office)
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