TURBOMOLE Users Forum
Installation and usage of TURBOMOLE => Parallel Runs => Topic started by: jlazare on August 24, 2015, 07:08:19 PM
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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.
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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