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[lammps-users] Accelerating ReaxFF simulations
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[lammps-users] Accelerating ReaxFF simulations


From: Rajesh <creativeidleminds@...24...>
Date: Sun, 27 Aug 2017 11:51:00 +0530

Dear lammps user
I am running reaxff simulations with openmpi with 20-35 -np processors with 3000-4000 atoms. Still I feel that simulations are rather slow. Is there  any way to accelerate them like some accelerator package? 

thanks

Rajesh