Dear Dr. Alberto Garcia,

Your note about vdw-dft calculation, which is in the following link, is not
perfectly clear to me.
​
https://www.mail-archive.com/siesta-l%40uam.es/msg08564.html
​
You mean ​t
o include vdW interaction in siesta, w we can use a  GGA PP for example
(revPBE) and just set
XC.Functional                 VDW
XC.authors                      DRSLL

I really appreciate your answer.
-Zara
physics  PhD student

Responder a