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| Original file line number | Diff line number | Diff line change |
|---|---|---|
| @@ -1,32 +1,32 @@ | ||
| # Tested with: GFortran 6.4.0, FFTW 3.3, LAPACK 3.5.0, Libxc 4.0.4 | ||
| # Author: Matthias Krack (matthias.krack@psi.ch, PSI, July 2018) | ||
| CC = gcc | ||
| CPP = | ||
| FC = gfortran | ||
| LD = gfortran | ||
| AR = ar -r | ||
| FFTW_INC = $(GCC_DIR)/fftw/3.3-regtest/include | ||
| FFTW_LIB = $(GCC_DIR)/fftw/3.3-regtest/lib | ||
| LIBINT_INC = $(GCC_DIR)/libint/1.1.4-default-regtest/include | ||
| LIBINT_LIB = $(GCC_DIR)/libint/1.1.4-default-regtest/lib | ||
| LIBXC_INC = $(GCC_DIR)/libxc/4.0.4-regtest/include | ||
| LIBXC_LIB = $(GCC_DIR)/libxc/4.0.4-regtest/lib | ||
| DFLAGS = -D__F2008 -D__FFTW3 -D__LIBINT -D__LIBXC | ||
| CPPFLAGS = | ||
| WFLAGS = -Waliasing -Wampersand -Wc-binding-type -Wconversion\ | ||
| -Wintrinsic-shadow -Wintrinsics-std -Wline-truncation\ | ||
| -Wno-tabs -Wrealloc-lhs-all -Wtarget-lifetime -Wunderflow\ | ||
| -Wunused-but-set-variable -Wunused-dummy-argument -Wunused-variable\ | ||
| -Werror | ||
| FCFLAGS = $(DFLAGS) -O1 -fcheck=bounds,do,recursion,pointer -ffree-form\ | ||
| -ffree-line-length-none -fimplicit-none -fno-omit-frame-pointer\ | ||
| -g -mtune=generic -std=f2008\ | ||
| -I$(FFTW_INC) -I$(LIBINT_INC) -I$(LIBXC_INC) $(WFLAGS) | ||
| LDFLAGS = $(FCFLAGS) -fsanitize=leak | ||
| LIBS = $(LIBPATH)/liblapack-gnu-regtest.a\ | ||
| $(LIBPATH)/libblas-gnu-regtest.a\ | ||
| $(FFTW_LIB)/libfftw3.a\ | ||
| $(LIBXC_LIB)/libxcf03.a\ | ||
| $(LIBXC_LIB)/libxc.a\ | ||
| $(LIBINT_LIB)/libderiv.a\ | ||
| $(LIBINT_LIB)/libint.a | ||
| # Tested with: GFortran 7.3.0, FFTW 3.3, LAPACK 3.5.0, Libint 1.1.4, Libxc 4.2.3 | ||
| # Author: Matthias Krack (matthias.krack@psi.ch, PSI, October 2018) | ||
| CC = gcc | ||
| CPP = | ||
| FC = gfortran | ||
| LD = gfortran | ||
| AR = ar -r | ||
| FFTW_INC = $(GCC_DIR)/fftw/3.3-regtest/include | ||
| FFTW_LIB = $(GCC_DIR)/fftw/3.3-regtest/lib | ||
| LIBINT_INC = $(GCC_DIR)/libint/1.1.4-default-regtest/include | ||
| LIBINT_LIB = $(GCC_DIR)/libint/1.1.4-default-regtest/lib | ||
| LIBXC_INC = $(GCC_DIR)/libxc/4.2.3-regtest/include | ||
| LIBXC_LIB = $(GCC_DIR)/libxc/4.2.3-regtest/lib | ||
| DFLAGS = -D__F2008 -D__FFTW3 -D__LIBINT -D__LIBXC | ||
| CPPFLAGS = | ||
| WFLAGS = -Waliasing -Wampersand -Wc-binding-type -Wconversion\ | ||
| -Wintrinsic-shadow -Wintrinsics-std -Wline-truncation\ | ||
| -Wno-tabs -Wrealloc-lhs-all -Wtarget-lifetime -Wunderflow\ | ||
| -Wunused-but-set-variable -Wunused-dummy-argument -Wunused-variable\ | ||
| -Werror | ||
| FCFLAGS = $(DFLAGS) -O1 -fcheck=bounds,do,recursion,pointer -ffree-form\ | ||
| -ffree-line-length-none -fimplicit-none -fno-omit-frame-pointer\ | ||
| -g -mtune=generic -std=f2008\ | ||
| -I$(FFTW_INC) -I$(LIBINT_INC) -I$(LIBXC_INC) $(WFLAGS) | ||
| LDFLAGS = $(FCFLAGS) -fsanitize=leak -static | ||
| LIBS = $(LIBPATH)/liblapack-gnu-regtest.a\ | ||
| $(LIBPATH)/libblas-gnu-regtest.a\ | ||
| $(FFTW_LIB)/libfftw3.a\ | ||
| $(LIBXC_LIB)/libxcf03.a\ | ||
| $(LIBXC_LIB)/libxc.a\ | ||
| $(LIBINT_LIB)/libderiv.a\ | ||
| $(LIBINT_LIB)/libint.a |
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| Original file line number | Diff line number | Diff line change |
|---|---|---|
| @@ -1,33 +1,33 @@ | ||
| # Tested with: GFortran 7.3.0, FFTW 3.3, LAPACK 3.5.0, Libxc 4.2.3 | ||
| # Author: Matthias Krack (matthias.krack@psi.ch, PSI, September 2018) | ||
| CC = gcc | ||
| CPP = | ||
| FC = gfortran | ||
| LD = gfortran | ||
| AR = ar -r | ||
| FFTW_INC = $(GCC_DIR)/fftw/3.3-regtest/include | ||
| FFTW_LIB = $(GCC_DIR)/fftw/3.3-regtest/lib | ||
| LIBINT_INC = $(GCC_DIR)/libint/1.1.4-default-regtest/include | ||
| LIBINT_LIB = $(GCC_DIR)/libint/1.1.4-default-regtest/lib | ||
| LIBXC_INC = $(GCC_DIR)/libxc/4.2.3-regtest/include | ||
| LIBXC_LIB = $(GCC_DIR)/libxc/4.2.3-regtest/lib | ||
| DFLAGS = -D__F2008 -D__FFTW3 -D__LIBINT -D__LIBXC | ||
| CPPFLAGS = | ||
| WFLAGS = -Waliasing -Wampersand -Wc-binding-type -Wconversion\ | ||
| -Wintrinsic-shadow -Wintrinsics-std -Wline-truncation\ | ||
| -Wno-tabs -Wrealloc-lhs-all -Wtarget-lifetime -Wunderflow\ | ||
| -Wunused-but-set-variable -Wunused-dummy-argument -Wunused-variable\ | ||
| -Werror | ||
| FCFLAGS = $(DFLAGS) -O1 -fcheck=bounds,do,recursion,pointer -ffree-form\ | ||
| -ffree-line-length-none -fimplicit-none -fno-omit-frame-pointer\ | ||
| -fopenmp -g -mtune=generic -std=f2008\ | ||
| -I$(FFTW_INC) -I$(LIBINT_INC) -I$(LIBXC_INC) $(WFLAGS) | ||
| LDFLAGS = $(FCFLAGS) -fsanitize=leak -static | ||
| LIBS = $(LIBPATH)/liblapack-gnu-regtest.a\ | ||
| $(LIBPATH)/libblas-gnu-regtest.a\ | ||
| $(FFTW_LIB)/libfftw3.a\ | ||
| $(FFTW_LIB)/libfftw3_threads.a\ | ||
| $(LIBXC_LIB)/libxcf03.a\ | ||
| $(LIBXC_LIB)/libxc.a\ | ||
| $(LIBINT_LIB)/libderiv.a\ | ||
| $(LIBINT_LIB)/libint.a | ||
| # Tested with: GFortran 7.3.0, FFTW 3.3, LAPACK 3.5.0, Libint 1.1.4, Libxc 4.2.3 | ||
| # Author: Matthias Krack (matthias.krack@psi.ch, PSI, October 2018) | ||
| CC = gcc | ||
| CPP = | ||
| FC = gfortran | ||
| LD = gfortran | ||
| AR = ar -r | ||
| FFTW_INC = $(GCC_DIR)/fftw/3.3-regtest/include | ||
| FFTW_LIB = $(GCC_DIR)/fftw/3.3-regtest/lib | ||
| LIBINT_INC = $(GCC_DIR)/libint/1.1.4-default-regtest/include | ||
| LIBINT_LIB = $(GCC_DIR)/libint/1.1.4-default-regtest/lib | ||
| LIBXC_INC = $(GCC_DIR)/libxc/4.2.3-regtest/include | ||
| LIBXC_LIB = $(GCC_DIR)/libxc/4.2.3-regtest/lib | ||
| DFLAGS = -D__F2008 -D__FFTW3 -D__LIBINT -D__LIBXC | ||
| CPPFLAGS = | ||
| WFLAGS = -Waliasing -Wampersand -Wc-binding-type -Wconversion\ | ||
| -Wintrinsic-shadow -Wintrinsics-std -Wline-truncation\ | ||
| -Wno-tabs -Wrealloc-lhs-all -Wtarget-lifetime -Wunderflow\ | ||
| -Wunused-but-set-variable -Wunused-dummy-argument -Wunused-variable\ | ||
| -Werror | ||
| FCFLAGS = $(DFLAGS) -O1 -fcheck=bounds,do,recursion,pointer -ffree-form\ | ||
| -ffree-line-length-none -fimplicit-none -fno-omit-frame-pointer\ | ||
| -fopenmp -g -mtune=generic -std=f2008\ | ||
| -I$(FFTW_INC) -I$(LIBINT_INC) -I$(LIBXC_INC) $(WFLAGS) | ||
| LDFLAGS = $(FCFLAGS) -fsanitize=leak -static | ||
| LIBS = $(LIBPATH)/liblapack-gnu-regtest.a\ | ||
| $(LIBPATH)/libblas-gnu-regtest.a\ | ||
| $(FFTW_LIB)/libfftw3.a\ | ||
| $(FFTW_LIB)/libfftw3_threads.a\ | ||
| $(LIBXC_LIB)/libxcf03.a\ | ||
| $(LIBXC_LIB)/libxc.a\ | ||
| $(LIBINT_LIB)/libderiv.a\ | ||
| $(LIBINT_LIB)/libint.a |