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qp2/etc/local.rc
2019-05-15 16:02:41 +02:00

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# Configuration specific to the local machine
# Maximum allowed memory per node
# export QP_MAXMEM=64
# Target number of threads for Davidson's algorithm (Hyperthreading is useful)
# export QP_NTHREADS_DAVIDSON=32
# Target number of threads for the computation of the PT2 (Hyperthreading is useful)
# export QP_NTHREADS_PT2=32
# Number of threads for MKL
# export MKL_NUM_THREADS=16
# Number of threads for OpenMP
# export OMP_NUM_THREADS=16
# Name of the network interface to be chosen
# export QP_NIC=lo
# export QP_NIC=ib0