mirror of
https://github.com/TREX-CoE/qmckl.git
synced 2024-07-03 01:46:12 +02:00
-DHAVE_CONFIG_H
This commit is contained in:
parent
e2ee986032
commit
66d606ff1e
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@ -51,7 +51,7 @@ $(distdir): $(qmckl_h) $(qmckl_f) $(static_lib) $(shared_lib) $(srcdir)/src/Make
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cp $(srcdir)/munit/munit.h munit/munit.c $(distdir)/munit/
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cp $(srcdir)/src/*.c src/*.h src/*.f90 $(distdir)/src/
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cp $(srcdir)/src/Makefile.generated.in $(distdir)/src/Makefile.in
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cp $(srcdir)/config.h.in $(distdir)/config.h.in
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cp $(srcdir)/include/config.h.in $(distdir)/include/config.h.in
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cp $(qmckl_h) $(distdir)/include
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cp $(srcdir)/Makefile.in $(distdir)/
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cp $(srcdir)/share/doc/qmckl/html/*.html $(distdir)/share/doc/qmckl/html/
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@ -1,5 +1,6 @@
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#!/bin/bash
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autoreconf --install
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automake --add-missing --copy > /dev/null 2>&1
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automake --add-missing --copy &> /dev/null
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exit 0
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26
configure.ac
26
configure.ac
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@ -10,7 +10,7 @@ AC_INIT([QMCkl],[0.1.1],
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[https://trex-coe.github.io/qmckl/index.html])
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AC_CONFIG_SRCDIR([src/README.org])
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AC_CONFIG_HEADERS([config.h])
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AC_CONFIG_HEADERS([include/config.h])
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AC_CONFIG_MACRO_DIR([m4])
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#AM_MAINTAINER_MODE
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@ -40,6 +40,7 @@ AC_PROG_INSTALL
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AC_PROG_LN_S
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AC_PROG_CC_C99
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AC_CHECK_PROGS([EMACS],[emacs26 emacs],[no])
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AC_CHECK_PROGS([HAS_CPPCHECK],[cppcheck],[no])
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PKG_PROG_PKG_CONFIG()
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PKG_LIBS=""
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PKG_CFLAGS=""
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@ -52,6 +53,13 @@ if test x${EMACS} == xno ; then
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])
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fi
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if test x${HAS_CPPCHECK} == xno ; then
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HAS_CPPCHECK=0
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else
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HAS_CPPCHECK=1
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fi
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AC_SUBST([HAS_CPPCHECK])
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# fPIC option
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AC_MSG_CHECKING(whether fPIC compiler option is accepted in C)
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SAVED_CFLAGS="${CFLAGS}"
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@ -120,22 +128,26 @@ if test "$ok" = "yes"; then
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-traceback -check all -debug all -fpe-all=0 -implicitnone"
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fi
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AC_DEFINE(DEBUG,1,[Define to turn on debugging checks])
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ARGS="${ARGS} debug"
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fi
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AC_ARG_ENABLE(debug-malloc, [AC_HELP_STRING([--enable-debug-malloc],[use debug malloc/free])], ok=$enableval, ok=no)
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AC_ARG_ENABLE(malloc-trace, [AC_HELP_STRING([--enable-malloc-trace],[use debug malloc/free])], ok=$enableval, ok=no)
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if test "$ok" = "yes"; then
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AC_DEFINE(DEBUG_MALLOC,1,[Define to use debugging malloc/free])
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AC_DEFINE(MALLOC_TRACE,"malloc_trace.dat",[Define to use debugging malloc/free])
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ARGS="${ARGS} malloc-trace"
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fi
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AC_ARG_ENABLE(prof, [AC_HELP_STRING([--enable-prof],[compile for profiling])], ok=$enableval, ok=no)
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if test "$ok" = "yes"; then
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CFLAGS="${CFLAGS} -pg"
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AC_DEFINE(ENABLE_PROF,1,[Define when using the profiler tool])
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ARGS="${ARGS} prof"
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fi
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AC_ARG_WITH(efence, [AC_HELP_STRING([--with-efence],[use ElectricFence library])], ok=$withval, ok=no)
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if test "$ok" = "yes"; then
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AC_CHECK_LIB(efence, malloc)
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ARGS="${ARGS} efence"
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fi
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AC_ARG_WITH(munit, [AC_HELP_STRING([--without-munit],[use munit for testing])], ok=yes, ok=no)
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@ -147,9 +159,9 @@ AC_CHECK_FILE([munit/munit.h], [],
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$ git submodule update --init
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-------------------------------------------------
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]) )
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AC_DEFINE(ENABLE_MUNIT,1,[Define when using munit])
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HAVE_MUNIT=1
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else
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ARGS="${ARGS} munit"
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AC_DEFINE(HAVE_MUNIT,1,[Define when using munit])
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fi
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@ -223,7 +235,7 @@ LDFLAGS: ${LDFLAGS}
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LIBS: ${LIBS}
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Package features:
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Compilation with HDF5: ${hdf5}
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${ARGS}
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Now type 'make @<:@<target>@:>@'
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where the optional <target> is:
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@ -1,14 +1,8 @@
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/* config.h.in. Generated from configure.ac by autoheader. */
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/* include/config.h.in. Generated from configure.ac by autoheader. */
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/* Define to turn on debugging checks */
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#undef DEBUG
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/* Define to use debugging malloc/free */
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#undef DEBUG_MALLOC
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/* Define when using munit */
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#undef ENABLE_MUNIT
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/* Define when using the profiler tool */
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#undef ENABLE_PROF
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@ -80,6 +74,9 @@
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/* Define to 1 if you have the `memset' function. */
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#undef HAVE_MEMSET
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/* Define when using munit */
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#undef HAVE_MUNIT
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/* Define to 1 if you have the `nl_langinfo' function. */
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#undef HAVE_NL_LANGINFO
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@ -150,6 +147,9 @@
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/* Define to 1 if the system has the type `_Bool'. */
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#undef HAVE__BOOL
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/* Define to use debugging malloc/free */
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#undef MALLOC_TRACE
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/* Define to 1 if your C compiler doesn't accept -c and -o together. */
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#undef NO_MINUS_C_MINUS_O
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@ -6,8 +6,11 @@ version = @PACKAGE_VERSION@
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prefix = @prefix@
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CC = @CC@
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CFLAGS= @CFLAGS@ -I../munit/ -I../include
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CC = @CC@
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DEFS = @DEFS@
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CFLAGS = @CFLAGS@ -I../munit/ -I../include -I. -I$(srcdir)
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CPPFLAGS = @CPPFLAGS@
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LIBS = @LIBS@
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FC = @FC@
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FCFLAGS= @FCFLAGS@
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@ -20,7 +23,7 @@ TESTS_F = test_qmckl_ao_f.o test_qmckl_distance_f.o
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LIBS = @LIBS@
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FCLIBS = @FCLIBS@
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QMCKL_ROOT=$(shell dirname $(CURDIR))
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QMCKL_ROOT=..
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shared_lib=$(QMCKL_ROOT)/lib/libqmckl.so
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static_lib=$(QMCKL_ROOT)/lib/libqmckl.a
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qmckl_h=$(QMCKL_ROOT)/include/qmckl.h
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@ -55,12 +58,13 @@ qmckl_f.o: $(qmckl_f)
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$(FC) $(FCFLAGS) -c $(qmckl_f) -o $@
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test_qmckl: test_qmckl.c $(qmckl_h) $(static_lib) $(TESTS) $(TESTS_F)
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$(CC) $(CFLAGS) $(munit) $(TESTS) $(TESTS_F) $(static_lib) $(LIBS) \
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$(FCLIBS) test_qmckl.c -o $@
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$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) $(munit) $(TESTS) $(TESTS_F) \
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$(static_lib) $(LIBS) $(FCLIBS) test_qmckl.c -o $@
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test_qmckl_shared: test_qmckl.c $(qmckl_h) $(shared_lib) $(TESTS) $(TESTS_F)
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$(CC) $(CFLAGS) -Wl,-rpath,$(QMCKL_ROOT)/lib -L$(QMCKL_ROOT)/lib \
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$(munit) $(TESTS) $(TESTS_F) -lqmckl $(LIBS) $(FCLIBS) test_qmckl.c -o $@
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$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) \
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-Wl,-rpath,$(QMCKL_ROOT)/lib -L$(QMCKL_ROOT)/lib $(munit) $(TESTS) \
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$(TESTS_F) -lqmckl $(LIBS) $(FCLIBS) test_qmckl.c -o $@
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check: test_qmckl test_qmckl_shared
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./test_qmckl
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@ -95,7 +99,7 @@ uninstall:
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.SUFFIXES: .c .f90 .o
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.c.o:
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$(CC) $(CFLAGS) -c $*.c -o $*.o
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$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) -c $*.c -o $*.o
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.f90.o: qmckl_f.o
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$(FC) $(FCFLAGS) -c $*.f90 -o $*.o
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@ -18,20 +18,24 @@ FC = @FC@
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CFLAGS = @CFLAGS@
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FCFLAGS = @FCFLAGS@
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LDFLAGS = @LDFLAGS@
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DEFS = @DEFS@
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# Variables
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HAS_CPPCHECK = @HAS_CPPCHECK@
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QMCKL_ROOT=$(shell dirname $(CURDIR))
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# VPATH-related substitution variables
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srcdir = @srcdir@
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VPATH = @srcdir@
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QMCKL_ROOT=$(srcdir)/..
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shared_lib=$(QMCKL_ROOT)/lib/libqmckl.so
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static_lib=$(QMCKL_ROOT)/lib/libqmckl.a
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qmckl_h=$(QMCKL_ROOT)/include/qmckl.h
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qmckl_f=$(QMCKL_ROOT)/share/qmckl/fortran/qmckl_f.f90
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export CC CFLAGS FC FCFLAGS LIBS QMCKL_ROOT
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export CC CFLAGS DEFS FC FCFLAGS LIBS QMCKL_ROOT
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ORG_SOURCE_FILES=$(wildcard $(QMCKL_ROOT)/*.org)
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C_SOURCE_FILES=$(patsubst %.org,%.c,$(ORG_SOURCE_FILES))
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@ -36,24 +36,33 @@ gradients and Laplacian of the atomic basis functions.
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* Headers :noexport:
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#+begin_src elisp :noexport :results none
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(org-babel-lob-ingest "../tools/lib.org")
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#+end_src
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#+end_src
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#+begin_src c :tangle (eval h_private_type)
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#ifndef QMCKL_AO_HPT
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#define QMCKL_AO_HPT
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#include <stdbool.h>
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#+end_src
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#+begin_src c :tangle (eval c_test) :noweb yes
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#include "qmckl.h"
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#include "munit.h"
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#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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MunitResult test_<<filename()>>() {
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qmckl_context context;
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context = qmckl_context_create();
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#+end_src
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#+begin_src c :tangle (eval c)
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#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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#include <stdint.h>
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#include <stdlib.h>
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#include <string.h>
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@ -7,6 +7,9 @@
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#+begin_src c :tangle (eval c_test) :noweb yes
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#include "qmckl.h"
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#include "munit.h"
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#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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MunitResult test_<<filename()>>() {
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#+end_src
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@ -25,6 +28,9 @@ MunitResult test_<<filename()>>() {
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#+end_src
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#+begin_src c :tangle (eval c)
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#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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#include <stdint.h>
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#include <assert.h>
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#include <math.h>
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@ -12,6 +12,9 @@ Functions for the computation of distances between particles.
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#+begin_src c :comments link :tangle (eval c_test) :noweb yes
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#include "qmckl.h"
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#include "munit.h"
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#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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MunitResult test_<<filename()>>() {
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qmckl_context context;
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context = qmckl_context_create();
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@ -21,12 +21,18 @@ up-spin and down-spin electrons, and the electron coordinates.
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#+begin_src c :tangle (eval c_test) :noweb yes
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#include "qmckl.h"
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#include "munit.h"
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#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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MunitResult test_<<filename()>>() {
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qmckl_context context;
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context = qmckl_context_create();
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#+end_src
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#+begin_src c :tangle (eval c)
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#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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#include <stdint.h>
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#include <stdlib.h>
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#include <string.h>
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@ -10,6 +10,9 @@
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#+end_src
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#+begin_src c :tangle (eval c)
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#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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#include <stdint.h>
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#include <string.h>
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#include <assert.h>
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@ -27,6 +30,9 @@
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#+begin_src c :tangle (eval c_test) :noweb yes
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#include "qmckl.h"
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#include "munit.h"
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#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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MunitResult test_<<filename()>>() {
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#+end_src
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@ -9,6 +9,9 @@ optimized libraries to fine-tune the memory allocation.
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* Headers :noexport:
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#+begin_src c :tangle (eval c)
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#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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#include <stdint.h>
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#include <stdlib.h>
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#include <string.h>
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@ -28,6 +31,9 @@ optimized libraries to fine-tune the memory allocation.
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#+begin_src c :tangle (eval c_test) :noweb yes
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#include "qmckl.h"
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#include "munit.h"
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#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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#include "qmckl_context_private_type.h"
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#include "qmckl_memory_private_func.h"
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MunitResult test_<<filename()>>() {
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|
|
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|||
|
|
@ -7,6 +7,9 @@
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#+begin_src c :tangle (eval c_test) :noweb yes
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#include "qmckl.h"
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#include "munit.h"
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||||
#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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||||
MunitResult test_<<filename()>>() {
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#+end_src
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@ -18,6 +21,9 @@ MunitResult test_<<filename()>>() {
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|||
#+end_src
|
||||
|
||||
#+begin_src c :tangle (eval c)
|
||||
#if HAVE_CONFIG_H
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#include <config.h>
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#endif
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||||
#include <stdint.h>
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||||
#include <assert.h>
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#include <math.h>
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|
|
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@ -82,6 +82,9 @@ echo "#+end_src"
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#include "qmckl.h"
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||||
#include "munit.h"
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||||
#include "mcheck.h"
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||||
#if HAVE_CONFIG_H
|
||||
#include <config.h>
|
||||
#endif
|
||||
<<headers>>
|
||||
|
||||
int main(int argc, char* argv[MUNIT_ARRAY_PARAM(argc + 1)]) {
|
||||
|
|
|
|||
|
|
@ -91,6 +91,7 @@ FC = @FC@
|
|||
CFLAGS = @CFLAGS@
|
||||
FCFLAGS = @FCFLAGS@
|
||||
LDFLAGS = @LDFLAGS@
|
||||
DEFS = @DEFS@
|
||||
|
||||
#+end_src
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||||
|
||||
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|
@ -109,7 +110,7 @@ static_lib=$(QMCKL_ROOT)/lib/libqmckl.a
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qmckl_h=$(QMCKL_ROOT)/include/qmckl.h
|
||||
qmckl_f=$(QMCKL_ROOT)/share/qmckl/fortran/qmckl_f.f90
|
||||
|
||||
export CC CFLAGS FC FCFLAGS LIBS QMCKL_ROOT
|
||||
export CC CFLAGS DEFS FC FCFLAGS LIBS QMCKL_ROOT
|
||||
|
||||
ORG_SOURCE_FILES=$(wildcard $(QMCKL_ROOT)/*.org)
|
||||
C_SOURCE_FILES=$(patsubst %.org,%.c,$(ORG_SOURCE_FILES))
|
||||
|
|
@ -243,8 +244,11 @@ version = @PACKAGE_VERSION@
|
|||
|
||||
prefix = @prefix@
|
||||
|
||||
CC = @CC@
|
||||
CFLAGS= @CFLAGS@ -I../munit/ -I../include
|
||||
CC = @CC@
|
||||
DEFS = @DEFS@
|
||||
CFLAGS = @CFLAGS@ -I../munit/ -I../include -I. -I\$(srcdir)
|
||||
CPPFLAGS = @CPPFLAGS@
|
||||
LIBS = @LIBS@
|
||||
|
||||
FC = @FC@
|
||||
FCFLAGS= @FCFLAGS@
|
||||
|
|
@ -268,7 +272,7 @@ and the rules:
|
|||
|
||||
#+NAME: rules
|
||||
#+begin_src makefile :tangle no
|
||||
QMCKL_ROOT=$(shell dirname $(CURDIR))
|
||||
QMCKL_ROOT=..
|
||||
shared_lib=$(QMCKL_ROOT)/lib/libqmckl.so
|
||||
static_lib=$(QMCKL_ROOT)/lib/libqmckl.a
|
||||
qmckl_h=$(QMCKL_ROOT)/include/qmckl.h
|
||||
|
|
@ -303,12 +307,13 @@ qmckl_f.o: $(qmckl_f)
|
|||
$(FC) $(FCFLAGS) -c $(qmckl_f) -o $@
|
||||
|
||||
test_qmckl: test_qmckl.c $(qmckl_h) $(static_lib) $(TESTS) $(TESTS_F)
|
||||
$(CC) $(CFLAGS) $(munit) $(TESTS) $(TESTS_F) $(static_lib) $(LIBS) \
|
||||
$(FCLIBS) test_qmckl.c -o $@
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) $(munit) $(TESTS) $(TESTS_F) \
|
||||
$(static_lib) $(LIBS) $(FCLIBS) test_qmckl.c -o $@
|
||||
|
||||
test_qmckl_shared: test_qmckl.c $(qmckl_h) $(shared_lib) $(TESTS) $(TESTS_F)
|
||||
$(CC) $(CFLAGS) -Wl,-rpath,$(QMCKL_ROOT)/lib -L$(QMCKL_ROOT)/lib \
|
||||
$(munit) $(TESTS) $(TESTS_F) -lqmckl $(LIBS) $(FCLIBS) test_qmckl.c -o $@
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) \
|
||||
-Wl,-rpath,$(QMCKL_ROOT)/lib -L$(QMCKL_ROOT)/lib $(munit) $(TESTS) \
|
||||
$(TESTS_F) -lqmckl $(LIBS) $(FCLIBS) test_qmckl.c -o $@
|
||||
|
||||
check: test_qmckl test_qmckl_shared
|
||||
./test_qmckl
|
||||
|
|
@ -343,7 +348,7 @@ uninstall:
|
|||
.SUFFIXES: .c .f90 .o
|
||||
|
||||
.c.o:
|
||||
$(CC) $(CFLAGS) -c $*.c -o $*.o
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) -c $*.c -o $*.o
|
||||
|
||||
.f90.o: qmckl_f.o
|
||||
$(FC) $(FCFLAGS) -c $*.f90 -o $*.o
|
||||
|
|
|
|||
|
|
@ -71,8 +71,11 @@ version = @PACKAGE_VERSION@
|
|||
|
||||
prefix = @prefix@
|
||||
|
||||
CC = @CC@
|
||||
CFLAGS= @CFLAGS@ -I../munit/ -I../include
|
||||
CC = @CC@
|
||||
DEFS = @DEFS@
|
||||
CFLAGS = @CFLAGS@ -I../munit/ -I../include -I. -I\$(srcdir)
|
||||
CPPFLAGS = @CPPFLAGS@
|
||||
LIBS = @LIBS@
|
||||
|
||||
FC = @FC@
|
||||
FCFLAGS= @FCFLAGS@
|
||||
|
|
@ -87,7 +90,7 @@ FCLIBS = @FCLIBS@
|
|||
EOF
|
||||
|
||||
echo '
|
||||
QMCKL_ROOT=$(shell dirname $(CURDIR))
|
||||
QMCKL_ROOT=..
|
||||
shared_lib=$(QMCKL_ROOT)/lib/libqmckl.so
|
||||
static_lib=$(QMCKL_ROOT)/lib/libqmckl.a
|
||||
qmckl_h=$(QMCKL_ROOT)/include/qmckl.h
|
||||
|
|
@ -122,12 +125,13 @@ qmckl_f.o: $(qmckl_f)
|
|||
$(FC) $(FCFLAGS) -c $(qmckl_f) -o $@
|
||||
|
||||
test_qmckl: test_qmckl.c $(qmckl_h) $(static_lib) $(TESTS) $(TESTS_F)
|
||||
$(CC) $(CFLAGS) $(munit) $(TESTS) $(TESTS_F) $(static_lib) $(LIBS) \
|
||||
$(FCLIBS) test_qmckl.c -o $@
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) $(munit) $(TESTS) $(TESTS_F) \
|
||||
$(static_lib) $(LIBS) $(FCLIBS) test_qmckl.c -o $@
|
||||
|
||||
test_qmckl_shared: test_qmckl.c $(qmckl_h) $(shared_lib) $(TESTS) $(TESTS_F)
|
||||
$(CC) $(CFLAGS) -Wl,-rpath,$(QMCKL_ROOT)/lib -L$(QMCKL_ROOT)/lib \
|
||||
$(munit) $(TESTS) $(TESTS_F) -lqmckl $(LIBS) $(FCLIBS) test_qmckl.c -o $@
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) \
|
||||
-Wl,-rpath,$(QMCKL_ROOT)/lib -L$(QMCKL_ROOT)/lib $(munit) $(TESTS) \
|
||||
$(TESTS_F) -lqmckl $(LIBS) $(FCLIBS) test_qmckl.c -o $@
|
||||
|
||||
check: test_qmckl test_qmckl_shared
|
||||
./test_qmckl
|
||||
|
|
@ -162,7 +166,7 @@ uninstall:
|
|||
.SUFFIXES: .c .f90 .o
|
||||
|
||||
.c.o:
|
||||
$(CC) $(CFLAGS) -c $*.c -o $*.o
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) -c $*.c -o $*.o
|
||||
|
||||
.f90.o: qmckl_f.o
|
||||
$(FC) $(FCFLAGS) -c $*.f90 -o $*.o
|
||||
|
|
|
|||
Loading…
Reference in New Issue
Block a user