[CPMD-list] MOVIE file

[Christel Nonnenberg]

Hi Veronique,

you have to use the keyword "MOVIE SAMPLE" and a number in the next line, 
which determines the steps after which the next structure is written to the 
MOVIE-file, e.g. 10, so every 10th step you will write a structure



-- 
Christel Nonnenberg
Ludwig-Maximilians-Universität München
Department Chemie
Butenandtstr. 5-13, Haus E
D-81377 München
Tel.: (089) 2180-7572
e-mail: Christel.Nonnenberg at cup.uni-muenchen.de