[DFTB-Plus-User] Use dftb+ by combing MPI with OpenMP
chy5603293
chy5603293 at 163.com
Tue Mar 1 16:11:02 CET 2011
Dear B�lint,
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,
Cheng
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