[Pw_forum] A few questions about MD simulations

Paolo Giannozzi paolo.giannozzi at uniud.it
Sat Jun 1 19:40:25 CEST 2013

On Sat, 2013-06-01 at 12:16 -0400, Robert Hembree wrote:

> when the run completes and the program exits the *.wfc files are gone

if you use "wf_collect=.true.", they are written with a different 
format into $prefix.save/K000001/ etc directories

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

More information about the users mailing list