mix the charge density and density matrix separately

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umklapp_sai
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mix the charge density and density matrix separately

#1 Post by umklapp_sai » Thu May 14, 2015 10:20 pm

Dear all,
I want to freeze the charge density but just relax the density matrix. Can this be realized in VASP?
Maybe just set the mixing parameters separately for charge density and density matrix. Can VASP do that?
Regards,
Sai

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Re: mix the charge density and density matrix separately

#2 Post by support_vasp » Tue Feb 18, 2025 12:51 pm

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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