[Pw_forum] vdW
Alexandra Davila
davila at theo-physik.uni-kiel.de
Wed May 31 12:26:01 CEST 2017
Hi QE users,
in order to calculate energies with the vdw functional, I have used
input_dft = 'vdW-DF'.
At the beginning of the output file, it is written:
Exchange-correlation = VDW-DF ( 1 4 4 0 1 0)
what do the ( 1 4 4 0 1 0) numbers mean?
Thanks !
--
A. Dávila
AG. Pehlke
Institut für Theoretische Physik und Astrophysik
Christian-Albrechts-Universität zu Kiel
Leibnizstr. 15
24118 Kiel
More information about the users
mailing list