Need help with superposition of a Fe-atom

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drikth

Need help with superposition of a Fe-atom

#1 Post by drikth » Sun Jun 10, 2012 11:15 pm

Hi

I am really new to VASP and I need help with a few basic things. From a CHGCAR-file I have retrieved a 112x96x96 matrix containing the charge density for a special simulation of 504 Fe-atoms. I also have a file containing the charge density from one Fe-atom depending on radial position from the Fe-atom. I need to know the difference between the 112x96x96 simulation and a superposition of "ordinary" Fe-atoms.
Is there someone out there who knows this?
I am doing this in MATLAB, so if anyone have any code that can solve this I would be very grateful.

//Daniel
Last edited by drikth on Sun Jun 10, 2012 11:15 pm, edited 1 time in total.

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Re: Need help with superposition of a Fe-atom

#2 Post by support_vasp » Thu Sep 12, 2024 7:56 am

Hi,

We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.

Best wishes,

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