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make.inc.basecamp.gcc.cpu
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#==============================================================================
# Exciting-Plus make.inc file for wyp-BaseCamp with GCC compilers
# Last edited: June 2, 2020 (WYP)
#==============================================================================
MAKE = make
COMPILER = gcc
# Compiler switch to turn on the preprocessor
CPP_OPTS = -cpp
# Add your custom preprocessor defines here
#CPP_OPTS +=
# Common compile time options
F90_OPTS = $(CPP_OPTS)
# Add your common compile time options here
#F90_OPTS +=
F90_OPTS += -fopt-info # show optimizations
#==============================================================================
# MPI
#==============================================================================
F90 = mpifort
CC = mpicc
CXX = mpic++
MPI_CPP_OPTS = -D_MPI_
CPP_OPTS += $(MPI_CPP_OPTS)
#==============================================================================
# OpenMP
#==============================================================================
# These are passed at compile time and link time
# Don't forget to `export OMP_STACKSIZE=2G` at runtime
OMP_OPTS = -fopenmp
#==============================================================================
# Serial compiler (for utilities)
#==============================================================================
F90SERIAL = gfortran
F90_OPTS_SERIAL = $(filter-out $(OMP_OPTS),$(filter-out $(MPI_CPP_OPTS),$(F90_OPTS)))
#==============================================================================
# Compiler and linker options
#==============================================================================
# Debugging
#F90_OPTS += -g
#F90_LINK_OPTS = $(F90_OPTS)
#EXE_SFX = dbg
# Debugging with extra checks
# (Don't forget to enable core dump generation using `ulimit -c unlimited`)
#F90_OPTS += -g -O0 -fbounds-check -fdump-core -fbacktrace -Wall
#F90_LINK_OPTS = $(F90_OPTS)
#EXE_SFX = dbgchk
# Optimization level 3 plus loop unrolling
F90_OPTS += -g -O3 -march=znver2 -funroll-loops
F90_LINK_OPTS = $(F90_OPTS) -fPIC
EXE_SFX = opt
# Profiling
#F90_OPTS += -pg -g -O3 -march=znver2 -funroll-loops
# Make sure to enable ESSL (see BLAS and LAPACK section)
#F90_LINK_OPTS = $(F90_OPTS) -fPIC
#EXE_SFX = prof
# Fully optimized build
#F90_OPTS += -g -Ofast -march=znver2 -funroll-loops
#F90_LINK_OPTS = $(F90_OPTS) -fPIC
#EXE_SFX = fast
# Profiling, fully optimized
#F90_OPTS += -pg -g -Ofast -march=znver2 -funroll-loops
#F90_LINK_OPTS = $(F90_OPTS) -fPIC
#EXE_SFX = fastprof
#==============================================================================
# BLAS and LAPACK
#==============================================================================
# Use reference BLAS and LAPACK from default Ubuntu repositories
#LAPACK_LIB = -lblas -llapack
# Use OpenBLAS
LAPACK_LIB = -L${OPENBLAS_DIR}/lib -lopenblas
# Use AMD AOCL
#LAPACK_LIB = -L${AOCLhome}/lib -lblis -lflame
#==============================================================================
# FFTW 3
#==============================================================================
# To disable, comment these three lines
FFT_INC = -I${FFTW_DIR}/include
FFT_LIB = -L${FFTW_DIR}/lib -lfftw3_omp -lfftw3 -lm
FFT_CPP_OPTS = -D_FFTW3_
CPP_OPTS += $(FFT_CPP_OPTS)
F90_OPTS += $(FFT_INC)
#==============================================================================
# HDF5
#==============================================================================
# To disable, comment these three lines
HDF5_INC = -I${HDF5_DIR}/include
HDF5_LIB = -L${HDF5_DIR}/lib -lhdf5_fortran -lhdf5_hl -lhdf5 -ldl
HDF5_CPP_OPTS = -D_HDF5_
CPP_OPTS += $(HDF5_CPP_OPTS)
F90_OPTS += $(HDF5_INC)
#==============================================================================
# Other libraries (retained here for historical purposes)
#==============================================================================
# ==- compile with libXC support ===
#CPP_OPTS := $(CPP_OPTS) -D_LIBXC_
#XC_LIB =
# ==- compile with NFFT support ===
#CPP_OPTS := $(CPP_OPTS) -D_NFFT_
#NFFT_INC = -I$(HOME)/local/include
#NFFT_LIB = $(HOME)/local/lib/libnfft3.a $(HOME)/local/lib/libfftw3.a
# === compile with Madness API ===
#CPP_OPTS := $(CPP_OPTS) -D_MAD_
#MADNESS_INC = -I$(HOME)/local/include
#MADNESS_LIB = -L$(HOME)/local/lib/ -lMADmra -lMADlinalg -lMADtensor -lMADmisc -lMADmuparser -lMADtinyxml -lMADworld -lmpichcxx -lstdc++
#==============================================================================
# List all libraries to link
#==============================================================================
LIBS = $(LAPACK_LIB) $(FFT_LIB) $(HDF5_LIB)