[Pw_forum] Can not restart a pbe0 calculation
Paolo Giannozzi
paolo.giannozzi at uniud.it
Wed Dec 4 16:22:29 CET 2013
On Wed, 2013-12-04 at 14:40 +0000, Lesheng Li wrote:
> I am now trying to run a pbe0 calculation with espresso,
> but when I restart the calculation, it seems just calculate
> from the beginning.
it's a known limitation of v.5.0.2. It has already been
fixed (I hope) in the development version
P.
--
Paolo Giannozzi, Dept. Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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