QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: Timbaktoo on July 29, 2009, 12:56

Title: SymmetryReducedTransmission.py
Post by: Timbaktoo on July 29, 2009, 12:56

I am using 2008.07 version of VNL for two-probe calculations.

To get the transmission coefficients and spectrum, the advanced tutorials says(for Windows) to:

· Create a new directory called site-packages (if it does not already exist) in the directory atk\lib.
· Copy the two files MonkhorstPack.py and SymmetryReducedTransmission.py into the site-packages directory.

I could find MonkhorstPack.py file in the vnl\exapmles directory but CAN'T find SymmetryReducedTransmission.py file. Can someone please send me this file?

Thanks.

Title: Re: SymmetryReducedTransmission.py
Post by: Anders Blom on July 29, 2009, 13:17

These files are provided in the file "transmission_scripts.zip" on the Tutorials page, just next to where to download the PDF file from (right-most column of the table). Please use the Monkhorst-Pack script from the ZIP file, as it's substantially updated compared to the older one in the Examples.

Title: Re: SymmetryReducedTransmission.py
Post by: Timbaktoo on July 29, 2009, 13:24

Thanks so much, Anders.