TURBOMOLE Users Forum
Installation and usage of TURBOMOLE => Parallel Runs => Topic started by: cest_la_vie on July 17, 2008, 12:31:34 AM
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Hi,
In turbomole v5.10
TURBOMOLE/mpirun_scripts> ls
dscf grad mpgrad rdgrad ricc2 riccprep ridft
There's no rimp2, and i can't find rimp2_mpi else where ???
How to run parallel rimp2 ?
Anyway, I would like to perform rimp2 single point calculation with COSMO.
Any suggestion ?
Best,
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Hi,
the parallel RI-MP2 is implemented in the ricc2 program, but RI-MP2 COSMO is only implemented in the rimp2 program at the moment. This is a bit confusing. There are efforts to combine the functionalities.
Best,
Arnim