My Community

Dear all,
Whan I performed magnetic calculation, I found that the magnetic moment in OUTCAR and CHGCAR are different.
IN OUTCAR the magmom mainly come from 6 atoms. But when I used the vaspvies to show the second part of CHGCAR ( the second part of CHGCAR is the magnetization density (spin up minus spin down)), the magmom come from different atoms. Would somebody give me some advice? Many thanks.
<span class='smallblacktext'>[ Edited ]</span>

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,

VASP