mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-11-20 12:22:21 +01:00
69 lines
1.9 KiB
INI
69 lines
1.9 KiB
INI
# On LUMI
|
|
#
|
|
# export SPACK_USER_PREFIX=$HOME/spack
|
|
# module swap PrgEnv-cray/8.3.3 PrgEnv-gnu/8.3.3
|
|
# module load spack/22.08
|
|
# module load openblas/0.3.17-gcc-omp-xi
|
|
# Common flags
|
|
##############
|
|
#
|
|
# -ffree-line-length-none : Needed for IRPF90 which produces long lines
|
|
# -lblas -llapack : Link with libblas and liblapack libraries provided by the system
|
|
# -I . : Include the curent directory (Mandatory)
|
|
#
|
|
# --ninja : Allow the utilisation of ninja. (Mandatory)
|
|
# --align=32 : Align all provided arrays on a 32-byte boundary
|
|
#
|
|
#
|
|
[COMMON]
|
|
FC : gfortran -ffree-line-length-none -I . -mavx -g -fPIC
|
|
LAPACK_LIB : -L/appl/lumi/spack/22.08/0.18.1/opt/spack/openblas-0.3.17-xinceno/lib -lopenblas
|
|
IRPF90 : irpf90
|
|
IRPF90_FLAGS : --ninja --align=32 -DSET_NESTED
|
|
|
|
# Global options
|
|
################
|
|
#
|
|
# 1 : Activate
|
|
# 0 : Deactivate
|
|
#
|
|
[OPTION]
|
|
MODE : OPT ; [ OPT | PROFILE | DEBUG ] : Chooses the section below
|
|
CACHE : 0 ; Enable cache_compile.py
|
|
OPENMP : 1 ; Append OpenMP flags
|
|
|
|
# Optimization flags
|
|
####################
|
|
#
|
|
# -Ofast : Disregard strict standards compliance. Enables all -O3 optimizations.
|
|
# It also enables optimizations that are not valid
|
|
# for all standard-compliant programs. It turns on
|
|
# -ffast-math and the Fortran-specific
|
|
# -fno-protect-parens and -fstack-arrays.
|
|
[OPT]
|
|
FCFLAGS : -Ofast -march=native
|
|
|
|
# Profiling flags
|
|
#################
|
|
#
|
|
[PROFILE]
|
|
FC : -p -g
|
|
FCFLAGS : -Ofast
|
|
|
|
# Debugging flags
|
|
#################
|
|
#
|
|
# -fcheck=all : Checks uninitialized variables, array subscripts, etc...
|
|
# -g : Extra debugging information
|
|
#
|
|
[DEBUG]
|
|
FCFLAGS : -fcheck=all -g
|
|
|
|
# OpenMP flags
|
|
#################
|
|
#
|
|
[OPENMP]
|
|
FC : -fopenmp
|
|
IRPF90_FLAGS : --openmp
|
|
|