Hello SIESTA Users,

Does anyone know any code to make "Quantum Theory of Atoms in Molecules"
studies from SIESTA results?

I am very interested in determine bond critical point density, ellipticity
and bonding.

Any hint/help will be very appreciated!

Regards,

Camps

PS: The Bader code from http://theory.cm.utexas.edu/bader/ do not give that
parameters, yet.

Responder a