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Author Topic: Spin Density  (Read 4138 times)

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Offline smaili

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Spin Density
« on: January 28, 2019, 13:38 »
Dear all,
I am new to atk and I am wondering how to calculate the spin density.  Is it possible to calculate it for a device?
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Offline Ulrik G. Vej-Hansen

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Re: Spin Density
« Reply #1 on: January 28, 2019, 14:49 »
You can calculate the electron density for a specific spin component, as described here: https://docs.quantumwise.com/manual/Types/ElectronDensity/ElectronDensity.html

Is that what you are looking for?
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Offline smaili

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Re: Spin Density
« Reply #2 on: January 29, 2019, 05:41 »
Thanks a lot for your response. I think it works.
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