p4vasp - molecule geometry

Queries about input and output files, running specific calculations, etc.


Moderators: Global Moderator, Moderator

Locked
Message
Author
benzoic acid

p4vasp - molecule geometry

#1 Post by benzoic acid » Wed Sep 29, 2010 10:31 am

Hi there,

I'm using p4vasp as a visualisation tool for my vasp calculated structures. There is an applet 'rotate atoms' - can I use that to rotate my molecule in a unit cell by defined angles and get the new atomic coordinates therefor? Such as getting new coordinates for multiplied unit cells?
Or is there a comprehensive manual somewhere, explaining the features of this programme?

Thanks for any help in advance,
benzoic acid
Last edited by benzoic acid on Wed Sep 29, 2010 10:31 am, edited 1 time in total.

support_vasp
Global Moderator
Global Moderator
Posts: 1817
Joined: Mon Nov 18, 2019 11:00 am

Re: p4vasp - molecule geometry

#2 Post by support_vasp » Wed Sep 11, 2024 2:28 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.

Best wishes,

VASP


Locked