LAMMPS

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Link Code Version Machine Date
Sandia website git repo Keeneland March 2011


Building with TAU

To start copy over the file Makefile.keeneland to the src/MAKE directory. Then do, 

cd src
make yes-user-cuda
cd ../lib/cuda
make lib
cd ../../src
export TAU_MAKEFILE=<path to TAU>/x86_64/lib/Makefile.tau-icpc-mpi-pdt
export TAU_OPTIONS='-optVerbose -optShared'
make keeneland CC+tau_cc.sh CXX=tau_cxx.sh F90=tau_f90.sh


configure TAU:

running: 

cd examples/USER/cuda
mpirun -np 3 tau_exec -T mpi,cupti,pdt -cupti $(LAMMPS_ROOT)/src/lmp_keeneland -sf cuda -cuda on < in.melt_5.0.cuda
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