Added make.inc for Fujitsu FX10: added option -x dir for cvray (prevents

misinterpretation of Intel !DIR$ directives)


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@13988 c92efa57-630b-4861-b058-cf58834340f0

install/README.FX10

@@ -0,0 +1,167 @@
+The following is tha "make.inc" file for Fujitsu FX10, a commercial version
+of the "K" supercomputer. Mitsuaki Kawamura, March 2017
+
+# make.inc.  Generated from make.inc.in by configure.
+
+# compilation rules
+
+.SUFFIXES :
+.SUFFIXES : .o .c .f .f90
+
+# most fortran compilers can directly preprocess c-like directives: use
+# 	$(MPIF90) $(F90FLAGS) -c $<
+# if explicit preprocessing by the C preprocessor is needed, use:
+# 	$(CPP) $(CPPFLAGS) $< -o $*.F90
+#	$(MPIF90) $(F90FLAGS) -c $*.F90 -o $*.o
+# remember the tabulator in the first column !!!
+
+.f90.o:
+	$(MPIF90) $(F90FLAGS) -c $<
+
+# .f.o and .c.o: do not modify
+
+.f.o:
+	$(F77) $(FFLAGS) -c $<
+
+.c.o:
+	$(CC) $(CFLAGS)  -c $<
+
+
+
+# Top QE directory, useful for locating libraries,  linking QE with plugins
+# The following syntax should always point to TOPDIR:
+TOPDIR = $(dir $(abspath $(filter %make.inc,$(MAKEFILE_LIST))))
+# if it doesn't work, uncomment the following line (edit if needed):
+
+# TOPDIR = 
+
+# DFLAGS  = precompilation options (possible arguments to -D and -U)
+#           used by the C compiler and preprocessor
+# FDFLAGS = as DFLAGS, for the f90 compiler
+# See include/defs.h.README for a list of options and their meaning
+# With the exception of IBM xlf, FDFLAGS = $(DFLAGS)
+# For IBM xlf, FDFLAGS is the same as DFLAGS with separating commas
+
+# MANUAL_DFLAGS  = additional precompilation option(s), if desired
+#                  BEWARE: it does not work for IBM xlf! Manually edit FDFLAGS
+MANUAL_DFLAGS  =
+DFLAGS         =  -D__FFTW3 -D__MPI -D__PARA -D__SCALAPACK
+FDFLAGS        = $(DFLAGS) $(MANUAL_DFLAGS)
+
+# IFLAGS = how to locate directories with *.h or *.f90 file to be included
+#          typically -I../include -I/some/other/directory/
+#          the latter contains .e.g. files needed by FFT libraries
+
+IFLAGS         = -I$(TOPDIR)/include -I../include/
+
+# MOD_FLAGS = flag used by f90 compiler to locate modules
+# Each Makefile defines the list of needed modules in MODFLAGS
+
+MOD_FLAG      = -I
+
+# Compilers: fortran-90, fortran-77, C
+# If a parallel compilation is desired, MPIF90 should be a fortran-90
+# compiler that produces executables for parallel execution using MPI
+# (such as for instance mpif90, mpf90, mpxlf90,...);
+# otherwise, an ordinary fortran-90 compiler (f90, g95, xlf90, ifort,...)
+# If you have a parallel machine but no suitable candidate for MPIF90,
+# try to specify the directory containing "mpif.h" in IFLAGS
+# and to specify the location of MPI libraries in MPI_LIBS
+
+MPIF90         = mpifrtpx
+#F90           = frtpx
+CC             = fccpx
+F77            = frtpx
+
+# C preprocessor and preprocessing flags - for explicit preprocessing,
+# if needed (see the compilation rules above)
+# preprocessing flags must include DFLAGS and IFLAGS
+
+CPP            = fccpx
+CPPFLAGS       = -P $(DFLAGS) $(IFLAGS)
+
+# compiler flags: C, F90, F77
+# C flags must include DFLAGS and IFLAGS
+# F90 flags must include MODFLAGS, IFLAGS, and FDFLAGS with appropriate syntax
+
+CFLAGS         = -O3 $(DFLAGS) $(IFLAGS)
+F90FLAGS       = $(FFLAGS) -Cpp $(FDFLAGS) $(IFLAGS) $(MODFLAGS)
+FFLAGS         = -Kfast -g -Ksimd=2 -Kprefetch_indirect -KXFILL #-Nquickdbg
+
+# compiler flags without optimization for fortran-77
+# the latter is NEEDED to properly compile dlamch.f, used by lapack
+
+FFLAGS_NOOPT   = -O0 -g
+
+# compiler flag needed by some compilers when the main program is not fortran
+# Currently used for Yambo
+
+FFLAGS_NOMAIN   = 
+
+# Linker, linker-specific flags (if any)
+# Typically LD coincides with F90 or MPIF90, LD_LIBS is empty
+
+LD             = mpifrtpx
+LDFLAGS        = -g
+LD_LIBS        = 
+
+# External Libraries (if any) : blas, lapack, fft, MPI
+
+# If you have nothing better, use the local copy :
+# BLAS_LIBS = /your/path/to/espresso/BLAS/blas.a
+# BLAS_LIBS_SWITCH = internal
+
+BLAS_LIBS      = -KSPARC64IXfx -SSL2BLAMP
+BLAS_LIBS_SWITCH = external
+
+# If you have nothing better, use the local copy :
+# LAPACK_LIBS = /your/path/to/espresso/lapack-3.2/lapack.a
+# LAPACK_LIBS_SWITCH = internal
+# For IBM machines with essl (-D__ESSL): load essl BEFORE lapack !
+# remember that LAPACK_LIBS precedes BLAS_LIBS in loading order
+
+LAPACK_LIBS    = 
+LAPACK_LIBS_SWITCH = external
+
+ELPA_LIBS_SWITCH = disabled
+SCALAPACK_LIBS = -SCALAPACK
+
+# nothing needed here if the the internal copy of FFTW is compiled
+# (needs -D__FFTW in DFLAGS)
+
+FFT_LIBS       = -lfftw3
+
+# HDF5 -- experimental
+HFD5_LIB = 
+
+# For parallel execution, the correct path to MPI libraries must
+# be specified in MPI_LIBS (except for IBM if you use mpxlf)
+
+MPI_LIBS       = 
+
+# IBM-specific: MASS libraries, if available and if -D__MASS is defined in FDFLAGS
+
+MASS_LIBS      = 
+
+# ar command and flags - for most architectures: AR = ar, ARFLAGS = ruv
+
+AR             = ar
+ARFLAGS        = ruv
+
+# ranlib command. If ranlib is not needed (it isn't in most cases) use
+# RANLIB = echo
+
+RANLIB         = ranlib
+
+# all internal and external libraries - do not modify
+
+FLIB_TARGETS   = all
+
+LIBOBJS        = $(TOPDIR)/clib/clib.a $(TOPDIR)/iotk/src/libiotk.a
+LIBS           = $(SCALAPACK_LIBS) $(LAPACK_LIBS) $(FFT_LIBS) $(BLAS_LIBS) $(MPI_LIBS) $(MASS_LIBS) ${HFD5_LIB} $(LD_LIBS)
+
+# wget or curl - useful to download from network
+WGET = wget -O
+
+# Install directory - not currently used
+PREFIX = /usr/local

install/configure

@@ -4642,7 +4642,8 @@ crayxt*:cray* )
         try_fflags="-O2"
         #NOTE: add '-rm' to get messages from crayftn about why
         #      optimizations have not been applied
-        try_f90flags="-O3,fp3 -f free"
+        #      -x dir disable directives introduced by !DIR$
+        try_f90flags="-O3,fp3 -f free -x dir"
         try_fflags_noopt="-O0"
         try_ldflags_openmp="-homp"
         try_ldflags="-v"

install/m4/x_ac_qe_f90.m4

@@ -107,7 +107,8 @@ crayxt*:cray* )
         try_fflags="-O2"
         #NOTE: add '-rm' to get messages from crayftn about why
         #      optimizations have not been applied
-        try_f90flags="-O3,fp3 -f free"
+        #      -x dir disable directives introduced by !DIR$
+        try_f90flags="-O3,fp3 -f free -x dir"
         try_fflags_noopt="-O0"
         try_ldflags_openmp="-homp"
         try_ldflags="-v"