VMD-L Mailing List

From: Diego Gomes (diego.enry_at_gmail.com)
Date: Fri Aug 02 2024 - 12:08:46 CDT

Hi Sri,
can you send me a sample CHGCAR file for me to check your request?

Friendly regards,
Diego.

On Wed, Jul 31, 2024 at 10:59 PM SKM <srikasi.qut_at_gmail.com> wrote:

> Hi
>
> I have a CHGCAR file of a 'double-layered' graphene, which, i presume'
> obviously contains the charge density values at each volume grid point,
> declared during the VASP computation, within the crystal lattice. I want to
> visualize this data as a 2D image that shows the integrated charge
> densities along the z-direction of the crystal lattice. This means creating
> a 2D planar figure that effectively displays the charge densities projected
> onto the xy-plane.
> Now can VMD have this feature to display such image?
>
> Regards
>
> Sri
> 

-- 
Diego Enry B. Gomes, PhD
Department of Physics at Auburn University &
NIH Center for Macromolecular Modeling and Visualization
Leach Science Center - Ste. 3182 - Auburn, AL
dgomes_at_auburn.edu