[Pw_forum] NEB restart from scratch

[Paolo Giannozzi]

On Tue, 2013-11-26 at 21:18 +0100, Paolo Giannozzi wrote:

>  very large forces (especially those around images 11 !!)

... and a very high energy, more than 36 Ry higher than 
for all other points. I would definitely have a closer 
look at point 11

P.
-- 
Paolo Giannozzi, Dept. Chemistry&Physics&Environment, 
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222