QuantumATK > General Questions and Answers

How to make a model from other soft

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QW2008:

--- Quote from: Nordland on December 21, 2008, 19:54 ---And by the way do you have access to the newest version of VNL?

--- End quote ---

No. But the newest version of VNL can be used by applying a temporary licience.

Nordland:
I have reworked a old atomic chain builder, I found.

I have attached it below, feel free to use.

The script should be adjusted to your needs, but no worry the script should be self-explained,
and it can be edited straight forward. When you are done, you can either drag and drop into the VNL
in order to visualize it or perform a calculation on the wire.

Below is a picture from VNL of a very strained gold wire with a Hydrogen defect causing some buckling in the middle.

Nordland:
I tried to do a little case study with the script and I tryed to simulated how the transmission spectrum depends on the strain of a lithium wire.

I tried to strain a perfect lithium wire by straining it by 1 Ang to 3 Ang over at distance of 5 atoms, and then took a look at how this effect the transmission spectrum.
I have attached the result in a little graph below.

QW2008:
Thanks Nordland.
I have learn much from you.

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