dipole correction for monoclinic or triclinic cells

To share experience including discussions about scientific questions.


Moderators: Global Moderator, Moderator

Post Reply
Message
Author
serenity_3
Newbie
Newbie
Posts: 13
Joined: Wed Jun 02, 2021 2:45 pm

dipole correction for monoclinic or triclinic cells

#1 Post by serenity_3 » Thu Jan 09, 2025 8:34 pm

Hello,
Is dipole correction supported for monoclinic or triclinic cells in VASP?
Thank you.


christopher_sheldon1
Global Moderator
Global Moderator
Posts: 89
Joined: Mon Mar 25, 2024 1:36 pm

Re: dipole correction for monoclinic or triclinic cells

#2 Post by christopher_sheldon1 » Mon Jan 13, 2025 9:27 am

Dear Serenity,

Thank you for your question. The dipole correction is implemented for triclinic and monoclinic cells, except for charged systems where only cubic cells are possible.

Best wishes,

Chris


Post Reply