QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: anir on July 25, 2012, 11:43

Title: bulkjunction script used as nanoribbon
Post by: anir on July 25, 2012, 11:43

can bulkjunction.py script be used for naoribbon as a channel

Title: Re: bulkjunction script used as nanoribbon
Post by: Anders Blom on July 25, 2012, 12:02

Perhaps, but not really comfortably. You really should look into the new Builder in ATK 12.2.

Title: Re: bulkjunction script used as nanoribbon
Post by: anir on July 25, 2012, 13:31

i want to build Au/armchair/Au two probe device...i have made armchair nano ribbon in the builder but
i am unable to create the Gold electrodes and interface it with the nanoribbon channel..
can you please help..

Title: Re: bulkjunction script used as nanoribbon
Post by: Anders Blom on July 25, 2012, 13:49

Which version of VNL?

Title: Re: bulkjunction script used as nanoribbon
Post by: anir on July 27, 2012, 08:33

atk 12.2.1

Title: Re: bulkjunction script used as nanoribbon
Post by: Anders Blom on July 27, 2012, 11:30

First of all, when you have time upgrade to 12.2.2, there are some bug fixes. For building such a system I suggest studying http://quantumwise.com/publications/tutorials/builder/172-building-a-molecular-junction-au-dtb-au, it's similar to your system.