Author Topic: Creating a metal-organic interface  (Read 420 times)

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Offline MrJo

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Creating a metal-organic interface
« on: June 19, 2020, 08:13 »
Hi everybody,

I have just started dealing with QuantumATK and I have tried to create a metal-organic interface. On Youtube, I found some tutorial videos by QuantumWise and in one of them, the creation of a pentacene molecule is shown. In this video, it is announced that a tutorial on how to create metal-organic interfaces would be released. However, I could not find such a tutorial, neither on Youtube nor on the QuantumATK website. In this forum, I read some entries in which the useres refer to this tutorial, but I cannot find it. Does anybody know, whether this tutorial has been removed from the website? Can I find it anywhere?

Looking forward to your help!

Best Regards,
Jakob

Offline mlee

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Re: Creating a metal-organic interface
« Reply #1 on: June 19, 2020, 08:31 »
See the linked documentary page for QuantumATK:
https://docs.quantumatk.com/

Offline MrJo

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Re: Creating a metal-organic interface
« Reply #2 on: June 19, 2020, 10:54 »
Thank you very much for your quick answer! Unfortunately, even if I check the link you attached, I don't find the tutorial regarding the Au-Pentacene interface. It seems to me that this tutorial has some kind of been deleted. Would you please tell me, where exactely I can find the tutorial? To be more precise: In the Youtube Video https://www.youtube.com/watch?v=YjB6s9Shd6U this tutorial is announced, but I could not find it.

Thanks in advance!

Offline mlee

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Re: Creating a metal-organic interface
« Reply #3 on: June 22, 2020, 09:07 »
Sorry to be inconvenient. The linked video was released in 2012. The tutorial has been changed.
If you are interested in Au-Pentacene interface, the below tutorials will be helpful:

https://docs.quantumatk.com/tutorials/interfaces.html
https://docs.quantumatk.com/tutorials/molecular_junction/molecular_junction.html

If you have in trouble to build your interface, let me know about it.