Author Topic: Utilization of more than 1 processors for RI-DFT M06-2x  (Read 7062 times)

jlazare

  • Newbie
  • *
  • Posts: 2
  • Karma: +0/-0
Utilization of more than 1 processors for RI-DFT M06-2x
« on: August 24, 2015, 07:08:19 PM »
I cannot utilize more than one processors for RI-DFT m06-2x functional.  I tested the same process using BP86 functional and the calculations went through normally. Can anybody explain why m06-2x doesn't work for m06-2x functional? The output file is attached regarding this issue. These calculations are done on a one methane molecule.

uwe

  • Global Moderator
  • Hero Member
  • *****
  • Posts: 560
  • Karma: +0/-0
Re: Utilization of more than 1 processors for RI-DFT M06-2x
« Reply #1 on: August 25, 2015, 10:51:55 AM »
Hi,

parallel jobs under Windows with RI-J and hybrid functionals are not supported. You can either use the Linux version instead, switch off RI and run it in parallel under Windows too - or run it in serial mode.

Regards,

Uwe