[Pw_forum] Restart point

Sergey Lisenkov proffess at yandex.ru
Thu Dec 2 08:04:54 CET 2004

Dear PWscf users and authors,

I performed geometry relaxation of a cluster. After that I increased the cut-off energy and specified the type of calculation "restart". But the code was stopped with error "error in reading prefix.rho" file. I switched again to "from_scratch" and put "startingpot='file'", but got the same error. It seems no restart point for this type of calculation with different cut-off energy. Am I right?

 Thank you very much,
   Best wishes,

More information about the users mailing list