[DFTB-Plus-User] Use dftb+ by combing MPI with OpenMP

chy5603293 chy5603293 at 163.com
Tue Mar 1 16:11:02 CET 2011

Dear Bálint,
I would like to run some MD simulations in parallel using 8 nodes which are on different computers, but I can not see the dftb+ thread in each node. How could I use dftb+ by combing MPI with OpenMP? In this case, the MPI can start one process on each node, and each of the node has  number of threads controlled by OpenMP.
Best regards,

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