mirror of https://gitlab.com/QEF/q-e.git
Machine-dependent makefiles updated
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2926 c92efa57-630b-4861-b058-cf58834340f0
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giannozz
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# make.sys for CRAY-XD1, enhanced version for CINECA by Carlo Cavazzoni
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# Edit according to your need
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# compilation rules
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.SUFFIXES :
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.SUFFIXES : .o .c .f .f90
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.f90.o:
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$(MPIF90) $(F90FLAGS) -c $<
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.f.o:
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$(F77) $(FFLAGS) -c $<
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.c.o:
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$(CC) $(CFLAGS) -c $<
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CC = pgcc
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MPICC = mpicc
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CFLAGS = -fast -Mpreprocess -O2 -tp amd64 -fastsse $(DFLAGS) $(IFLAGS)
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CPP = cpp
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CPPFLAGS = -P -traditional $(DFLAGS) $(IFLAGS)
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F90 = pgf90
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MPIF90 = mpif90
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F90FLAGS = $(FFLAGS) $(FDFLAGS) $(IFLAGS) $(MODFLAGS)
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F90FLAGS_NOOPT = $(FFLAGS_NOOPT) $(FDFLAGS) $(IFLAGS) $(MODFLAGS)
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F77 = pgf77
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MPIF77 = mpif77
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FFLAGS = -fast -r8 -Mpreprocess -O2 -tp amd64 -fastsse
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FFLAGS_NOOPT = -O0
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LD = mpif90
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LDFLAGS =
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AR = ar
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ARFLAGS = ruv
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RANLIB = echo
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BLAS_LIBS = -L/opt/acml2.5-64bit/pgi64/lib/ -lacml
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LAPACK_LIBS =
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FFT_LIBS =
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MPI_LIBS =
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MASS_LIBS =
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# -----------------------------
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# application-specific settings
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# See include/defs.h.README for a list of precompilation options
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# (possible arguments to -D or -U) and their meaning
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#DFLAGS = -D__LINUX64 -D__PGI -D__FFTW -D__USE_INTERNAL_FFTW -D__MPI -D__PARA -D__NOSMD
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DFLAGS = -D__LINUX64 -D__PGI -D__FFTW -D__USE_INTERNAL_FFTW -D__MPI -D__PARA
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FDFLAGS = $(DFLAGS)
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IFLAGS = -I../include
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MODFLAGS = -I. -I../Modules -I../PW -I../PH -I../iotk/src -I../CPV
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LIBOBJS = ../flib/ptools.a ../flib/flib.a ../clib/clib.a ../iotk/src/libiotk.a
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# LIBS must contain the location of all needed external libraries
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LIBS = $(LAPACK_LIBS) $(BLAS_LIBS) $(FFT_LIBS) $(MPI_LIBS) $(MASS_LIBS)
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# MYLIB can be one of the following (depending on LIBS):
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# blas : compile the local copy of blas routines
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# lapack : compile the local copy of lapack routines
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# blas_and_lapack : all of the above - use this for a quick test
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# or if you don't have an optimized blas/lapack library
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# lapack_ibm : compile only lapack routines not present in IBM ESSL
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# use this together with IBM ESSL
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# lapack_t3e : compile only lapack routines not present in T3E scilib
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# use this together with T3E scilib
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# lapack_mkl : compile only lapack routines not present in Intel MKL
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# use this together with Intel MKL
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MYLIB =
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$(CC) $(CFLAGS) -c $<
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## If the mass library is available, use
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# CPPFLAGS = -D__AIX,-D__MASS,-DHAS_ZHEGVX
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# CPPFLAGS = -D__AIX,-D__ESSL,-D__MASS
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CPPFLAGS = -D__AIX,-DHAS_ZHEGVX
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CPPFLAGS = -D__AIX,-D__ESSL
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# Fortran compiler:
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# Use -g -C without -s in LDFLAGS for debugging
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$(CC) $(CFLAGS) -c $<
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## If the mass library is available, use
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# CPPFLAGS = -D__AIX,-D__PARA,-D__MPI,-D__MASS,-DHAS_ZHEGVX
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# CPPFLAGS = -D__AIX,-D__PARA,-D__MPI,-D__MASS,-D__ESSL
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CPPFLAGS = -D__AIX,-D__PARA,-D__MPI,-DHAS_ZHEGVX
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CPPFLAGS = -D__AIX,-D__PARA,-D__MPI,-D__ESSL
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# Fortran compiler:
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# Use -g -C without -s in LDFLAGS for debugging
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# See include/defs.h.README for a list of precompilation options
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# (possible arguments to -D or -U) and their meaning
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DFLAGS = -D__MAC -D__XLF -D__FFTW -D__USE_INTERNAL_FFTW
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FDFLAGS = -D__MAC,-D__XLF,-D__FFTW,-D__USE_INTERNAL_FFTW
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DFLAGS = -D__MAC -D__FFTW -D__USE_INTERNAL_FFTW
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FDFLAGS = -D__MAC,-D__FFTW,-D__USE_INTERNAL_FFTW
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IFLAGS = -I../include
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MODFLAGS = -I. -I../Modules -I../PW -I../PH -I../iotk/src
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# System-dependent definitions for t3e using MPI
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# Edit according to your needs
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.SUFFIXES :
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.SUFFIXES : .o .c .f .f90
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.f90.o:
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$(F90) $(F90FLAGS) -c $<
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.f.o:
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$(F77) $(FFLAGS) -c $<
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.c.o:
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$(CC) $(CFLAGS) -c $<
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CPP = /opt/ctl/bin/cpp
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# add -D__BENCHLIB to CPPFLAGS if the benchlib is installed
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## Use fft routines from mathematical t3e libraries
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# CPPFLAGS = -I../include -D__T3E -D__PARA -D__MPI
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## Use precompiled fftw library (version <= 2.1.5, NOT v.3!)
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## In this case, specify also how to load the fftw library (FFTW_LIB)
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## and the path to the fftw.h include file (FFTW_INC_DIR). Example:
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# FFTW_LIB = -L/usr/local/src/fftw-2.1.3/fftw/.libs -lfftw
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# FFTW_INC_DIR = /usr/local/src/fftw-2.1.3/fftw
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# CPPFLAGS = -D__T3E -D__PARA -D__MPI -D__FFTW -I../include \
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# -I$(FFTW_INC_DIR)
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# Use the local copy of fftw
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CPPFLAGS = -D__T3E -D__PARA -D__MPI -D__FFTW -D__USE_INTERNAL_FFTW \
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-I../include -I.
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CC = cc
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MPICC = cc
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F90 = f90
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MPIF90 = f90
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F77 = f90
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MPIF77 = f90
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# you may need to add -Idir, where "dir"=directory where mpif.h resides
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# with -M1110 flag compiler does not issue warning messages for
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# the use of DOUBLE PRECISION constants in the code. (SdG)
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# More aggressive optimization flags:
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# FFLAGS = -O3 -O unroll2 -O pipeline3 -O aggress -O fusion -O bl -eZ
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FFLAGS = -em -dp -M1110 -eZ
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F90FLAGS = $(FFLAGS) -F $(CPPFLAGS) -p../Modules -p../PW -p../PH
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CFLAGS = $(CPPFLAGS) -O2
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# usually blas and lapack are automatically loaded
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# and only fftw (if required) and mpi need to be specified
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# if you use -D__BENCHLIB, load the benchlib as well :
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# -l _scalar -l _vect -l _ereg
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LIBS = $(FFTW_LIB) -lmpi
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# this contains auxiliary routines missing in T3E lapack
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MYLIB = lapack_t3e
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LD = $(MPIF90)
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LDFLAGS = ../flib/ptools.a ../flib/flib.a ../clib/clib.a
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AR = ar
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ARFLAGS = ruv
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RANLIB = echo
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