Dear all,
After searching the manual and the forums without success, I decided to write here.
I need to run a few NEB simulations in an AFM system. The atom that I want to study is changing from a positive magnetic moment to a negative magnetic moment, of equal magnitude. In the VASP setup, if I am not mistaken, the initial guess for the magnetic moment is provided in the INCAR file. This file is, for a NEB simulation, only given once, and therefore so is the MAGMOM tag.
The question is about how should one proceed to to a NEB calculation in an AFM system. To which image(s) is applied the MAGMOM provided?
Thank you for your time
NEB for an AFM system
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Re: NEB for an AFM system
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.
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