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Dft-negf
Date: 2017/06/26 06:49
Name:
Jeffri
Hi
Transport depends on bandgap, electron mass ,...
As we know dft underestimate bandgap. Is the I-V curve overestimated by dft-negf?
Thanks
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Re: Dft-negf
( No.1 )
Date: 2017/06/27 14:27
Name:
T. Ozaki
Hi,
As you think, the I-V characteristic should reflect underestimated LDA/GGA band gaps.
Regards,
TO
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Dft-negf
Re: Dft-negf