#!/usr/bin/env python3 # Example configure script for Cray XC-series systems with Intel "Knights # Landing" (KNL) processors. # This script was constructed for and tested on the Cori XC40 system, but # should work (or be easily modified to do so) on other Cray XC-series systems. if __name__ == '__main__': import os import sys sys.path.insert(0, os.path.abspath('config')) import configure configure_options = [ # We use the Cray compiler wrappers below, regardless of what underlying # compilers we are actually using. '--with-cc=cc', '--with-cxx=CC', '--with-fc=ftn', # Cray supports the use of Intel, Cray, or GCC compilers. # Make sure that the correct programming environment module is loaded, # and then comment/uncomment the appropriate stanzas below. # Flags for the Intel compilers: # NOTE: For versions of the Intel compiler < 18.x, one may need to specify # the undocumented compiler option '-mP2OPT_hpo_vec_remainder=F', which # disables generation of vectorized remainder loops; this works around # some incorrect code generation. This option should NOT be used with later # compiler versions -- it is detrimental to performance, and the behavior # may change without warning because this is an undocumented option. '--COPTFLAGS=-g -xMIC-AVX512 -O3', '--CXXOPTFLAGS=-g -xMIC-AVX512 -O3', '--FOPTFLAGS=-g -xMIC-AVX512 -O3', # Use BLAS and LAPACK provided by Intel MKL. # (Below only works when PrgEnv-intel is loaded; it is possible, but not # straightforward, to use MKL on Cray systems with non-Intel compilers.) # If Cray libsci is preferred, comment out the line below. '--with-blaslapack-lib=-mkl -L' + os.environ['MKLROOT'] + '/lib/intel64', # Prefer hand-coded kernels using AVX-512 intrinsics when available. '--with-avx512-kernels=1', # Flags for the Cray compilers: # '--COPTFLAGS=-g -hcpu=mic-knl' # '--CXXOPTFLAGS=-g -hcpu=mic-knl' # '--FOPTFLAGS=-g -hcpu=mic-knl' # Flags for the GCC compilers: # '--COPTFLAGS=-g -march=knl -O3 -mavx512f -mavx512cd -mavx512er -mavx512pf', # '--CXXOPTFLAGS=-g -march=knl -O3 -mavx512f -mavx512cd -mavx512er -mavx512pf', # '--FOPTFLAGS=-g -march=knl -O3 -mavx512f -mavx512cd -mavx512er -mavx512pf', '--with-debugging=no', '--with-memalign=64', '--with-mpiexec=srun', # Some systems (e.g., ALCF Theta) use '--with-mpiexec=aprun' instead. '--known-mpi-shared-libraries=1', '--with-clib-autodetect=0', '--with-fortranlib-autodetect=0', '--with-cxxlib-autodetect=0', '--LIBS=-lstdc++', '--LDFLAGS=-dynamic', # Needed if wish to use dynamic shared libraries. # Below "--known-" options are from the "reconfigure.py" script generated # after an initial configure.py run using '--with-batch'. '--known-level1-dcache-size=32768', '--known-level1-dcache-linesize=64', '--known-level1-dcache-assoc=8', '--known-sdot-returns-double=0', '--known-snrm2-returns-double=0', '--known-has-attribute-aligned=1', '--known-64-bit-blas-indices=0', '--with-batch=1', ] configure.petsc_configure(configure_options)