Dear Developers,
I have a heavily doped semiconductor.
For the RPA calculations (without considering QP corrected database or any scissor operator)
I did not use any Drude term but in the report files I have some warning for that
So I used some values for Drude term
but the spectrum is not true
and it is different from the one with 0 values!!!
I have used other values but unfortunately I got the same spectrum
and the one with 0 values is more reliable!!!
I've attached two spectrum.
I would be thankful if you can help me with this problem.
Best regards
Drudeterm in RPA
Moderators: Davide Sangalli, andrea.ferretti, myrta gruning, andrea marini, Daniele Varsano, Conor Hogan
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samaneh
- Posts: 165
- Joined: Tue Jan 21, 2014 9:03 am
Drudeterm in RPA
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S. Ataei, PhD student at University of Tehran, Iran.
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Daniele Varsano
- Posts: 4198
- Joined: Tue Mar 17, 2009 2:23 pm
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Re: Drudeterm in RPA
Dear Samaneh,
please fill your signature with your affiliation. You do not need to write your affiliation in every post but you need to fill it once:
User Control Panel --> Profile--> Signature and fill it once for all.
Next, it is not easy to understand what is happening form the plot. Please post input/output and report, so we can inspect what is going wrong.
Best,
Daniele
please fill your signature with your affiliation. You do not need to write your affiliation in every post but you need to fill it once:
User Control Panel --> Profile--> Signature and fill it once for all.
Next, it is not easy to understand what is happening form the plot. Please post input/output and report, so we can inspect what is going wrong.
Best,
Daniele
Dr. Daniele Varsano
S3-CNR Institute of Nanoscience and MaX Center, Italy
MaX - Materials design at the Exascale
http://www.nano.cnr.it
http://www.max-centre.eu/
S3-CNR Institute of Nanoscience and MaX Center, Italy
MaX - Materials design at the Exascale
http://www.nano.cnr.it
http://www.max-centre.eu/