[gmx-users] Re: hkl harker sections

[Dr. Vitaly V. Chaban]

> Hello all,
>
> Does anyone know where to look to do a slice of my unit cell along sections (energies, forces etc...)  or to just give a list of all atoms in the slice.  Something like an h,k,l or x,y,z slice through a section.
>
> Stephan Watkins
> --


I believe the only way is to construct the index file by hand.


Dr. Vitaly V. Chaban, 430 Hutchison Hall, Chem. Dept.
Univ. Rochester, Rochester, New York 14627-0216
THE UNITED STATES OF AMERICA