[Q-e-developers] compilation error with older gfortran version
Paolo Giannozzi
giannozz at democritos.it
Sun Feb 17 21:07:16 CET 2013
On Feb 17, 2013, at 19:40 , Laszlo Fusti-Molnar wrote:
> I am very sad that PW91 functional was not implemented correctly in
> the 4.x releases
the implementation WAS correct. Only the case in which "PW91" was
explicitly supplied
in input as functional (instead of using what was written in PP
files) wasn't
P.
--
Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
More information about the developers
mailing list