------------------------------------------------------------------------------- -- Phase: Environment ------------------------------------------------------------------------------- NO_DEPENDS=1 UNAME_r=6.5 UNAME_m=x86_64 UNAME_p=x86_64 UNAME_v=unknown UNAME_s=DragonFly PATH=/sbin:/bin:/usr/sbin:/usr/bin:/usr/local/sbin:/usr/local/bin SSL_NO_VERIFY_PEER=1 LANG=C HOME=/root USER=root TERM=dumb SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: showconfig ------------------------------------------------------------------------------- SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: CONFIGURE_ENV ------------------------------------------------------------------------------- F77="gfortran12" F90="gfortran12" FC="gfortran12" FFLAGS="-O -Wl,-rpath=/usr/local/lib/gcc12" F90FLAGS="-O -Wl,-rpath=/usr/local/lib/gcc12" FCFLAGS="-Wl,-rpath=/usr/local/lib/gcc12" XDG_DATA_HOME=/construction/science/packmol XDG_CONFIG_HOME=/construction/science/packmol XDG_CACHE_HOME=/construction/science/packmol/.cache HOME=/construction/science/packmol TMPDIR="/tmp" PATH=/construction/science/packmol/.bin:/sbin:/bin:/usr/sbin:/usr/bin:/usr/local/sbin:/usr/local/bin PKG_CONFIG_LIBDIR=/construction/science/packmol/.pkgconfig:/usr/local/libdata/pkgconfig:/usr/local/share/pkgconfig:/usr/libdata/pkgconfig SHELL=/bin/sh CONFIG_SHELL=/bin/sh CCVER=gcc80 SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: CONFIGURE_ARGS ------------------------------------------------------------------------------- SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: MAKE_ENV ------------------------------------------------------------------------------- F77="gfortran12" F90="gfortran12" FC="gfortran12" FFLAGS="-O -Wl,-rpath=/usr/local/lib/gcc12" F90FLAGS="-O -Wl,-rpath=/usr/local/lib/gcc12" FCFLAGS="-Wl,-rpath=/usr/local/lib/gcc12" XDG_DATA_HOME=/construction/science/packmol XDG_CONFIG_HOME=/construction/science/packmol XDG_CACHE_HOME=/construction/science/packmol/.cache HOME=/construction/science/packmol TMPDIR="/tmp" PATH=/construction/science/packmol/.bin:/sbin:/bin:/usr/sbin:/usr/bin:/usr/local/sbin:/usr/local/bin PKG_CONFIG_LIBDIR=/construction/science/packmol/.pkgconfig:/usr/local/libdata/pkgconfig:/usr/local/share/pkgconfig:/usr/libdata/pkgconfig MK_DEBUG_FILES=no MK_KERNEL_SYMBOLS=no SHELL=/bin/sh NO_LINT=YES CCVER=gcc80 ADDR2LINE="/usr/local/bin/addr2line" AR="/usr/local/bin/ar" AS="/usr/local/bin/as" CPPFILT="/usr/local/bin/c++filt" GPROF="/usr/local/bin/gprof" LD="/usr/local/bin/ld" NM="/usr/local/bin/nm" OBJCOPY="/usr/local/bin/objcopy" OBJDUMP="/usr/local/bin/objdump" RANLIB="/usr/local/bin/ranlib" READELF="/usr/local/bin/readelf" SIZE="/usr/local/bin/size" STRINGS="/usr/local/bin/strings" PREFIX=/usr/local LOCALBASE=/usr/local NOPROFILE=1 CC="cc" CFLAGS="-pipe -O2 -fno-strict-aliasing " CPP="cpp" CPPFLAGS="" LDFLAGS=" -Wl,-rpath=/usr/local/lib/gcc12 -L/usr/local/lib/gcc12 -B/usr/local/bin " LIBS="" CXX="c++" CXXFLAGS=" -pipe -O2 -fno-strict-aliasing " MANPREFIX="/usr/local" BSD_INSTALL_PROGRAM="install -s -m 555" BSD_INSTALL_LIB="install -s -m 0644" BSD_INSTALL_SCRIPT="install -m 555" BSD_INSTALL_DATA="install -m 0644" BSD_INSTALL_MAN="install -m 444" SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: MAKE_ARGS ------------------------------------------------------------------------------- DESTDIR=/construction/science/packmol/stage SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: PLIST_SUB ------------------------------------------------------------------------------- CMAKE_BUILD_TYPE="release" OSREL=6.5 PREFIX=%D LOCALBASE=/usr/local RESETPREFIX=/usr/local LIB32DIR=lib PROFILE="@comment " DOCSDIR="share/doc/packmol" EXAMPLESDIR="share/examples/packmol" DATADIR="share/packmol" WWWDIR="www/packmol" ETCDIR="etc/packmol" SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: SUB_LIST ------------------------------------------------------------------------------- PREFIX=/usr/local LOCALBASE=/usr/local DATADIR=/usr/local/share/packmol DOCSDIR=/usr/local/share/doc/packmol EXAMPLESDIR=/usr/local/share/examples/packmol WWWDIR=/usr/local/www/packmol ETCDIR=/usr/local/etc/packmol SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: /etc/make.conf ------------------------------------------------------------------------------- DPORTS_BUILDER=yes DISABLE_LICENSES=yes DEFAULT_VERSIONS=ssl=openssl FORCE_PACKAGE=yes DEVELOPER=yes DFLY_STING_XFAIL=yes USE_PACKAGE_DEPENDS_ONLY=yes PORTSDIR=/xports PORT_DBDIR=/options PKG_DBDIR=/var/db/pkg PKG_CACHEDIR=/var/cache/pkg PKG_COMPRESSION_FORMAT=.tgz DEVELOPER=1 WITH_CCACHE_BUILD=yes CCACHE_DIR=/ccache UID=0 ARCH=x86_64 OPSYS=DragonFly DFLYVERSION=600503 OSVERSION=9999999 OSREL=6.5 _OSRELEASE=6.5-SYNTH DISTDIR=/distfiles WRKDIRPREFIX=/construction BATCH=yes PACKAGE_BUILDING=yes PKG_CREATE_VERBOSE=yes MAKE_JOBS_NUMBER=13 SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: setup ------------------------------------------------------------------------------- Installing /packages/All/expat-2.5.0.pkg Installing /packages/All/libuv-1.46.0.pkg Installing /packages/All/indexinfo-0.3.1.pkg Installing /packages/All/gettext-runtime-0.21.1.pkg Installing /packages/All/openssl-1.1.1u,1.pkg Installing /packages/All/rhash-1.4.3.pkg Installing /packages/All/pkg-1.19.2.pkg Installing /packages/All/liblz4-1.9.4,1.pkg pkg: Repository Avalon cannot be opened. 'pkg update' required Installing /packages/All/zstd-1.5.5.pkg pkg: Repository Avalon cannot be opened. 'pkg update' required Installing /packages/All/libarchive-3.6.2,1.pkg pkg: Repository Avalon cannot be opened. 'pkg update' required Installing /packages/All/ncurses-6.4.pkg pkg: Repository Avalon cannot be opened. 'pkg update' required ===== Message from ncurses-6.4: -- To get the terminfo database please install the terminfo-db package: pkg install terminfo-db Installing /packages/All/cmake-core-3.26.1_1.pkg pkg: Repository Avalon cannot be opened. 'pkg update' required Installing /packages/All/gmp-6.2.1.pkg pkg: Repository Avalon cannot be opened. 'pkg update' required Installing /packages/All/mpfr-4.2.0_1,1.pkg pkg: Repository Avalon cannot be opened. 'pkg update' required Installing /packages/All/mpc-1.3.1_1.pkg pkg: Repository Avalon cannot be opened. 'pkg update' required UNFLAVORED devel/binutils -> use devel/binutils@native Installing /packages/All/binutils-2.40_4,1.pkg pkg: Repository Avalon cannot be opened. 'pkg update' required Installing /packages/All/gcc12-12.2.0_6.pkg pkg: Repository Avalon cannot be opened. 'pkg update' required ===== Message from gcc12-12.2.0_6: -- To ensure binaries built with this toolchain find appropriate versions of the necessary run-time libraries, you may want to link using -Wl,-rpath=/usr/local/lib/gcc12 For ports leveraging USE_GCC, USES=compiler, or USES=fortran this happens transparently. Installing /packages/All/ccache-3.7.12_4.pkg pkg: Repository Avalon cannot be opened. 'pkg update' required Create compiler links... create symlink for cc create symlink for cc (world) create symlink for c++ create symlink for c++ (world) create symlink for CC create symlink for CC (world) create symlink for gcc create symlink for gcc (world) create symlink for g++ create symlink for g++ (world) create symlink for gcc12 create symlink for gcc12 (world) create symlink for g++12 create symlink for g++12 (world) create symlink for cpp12 create symlink for cpp12 (world) ===== Message from ccache-3.7.12_4: -- NOTE: Please read /usr/local/share/doc/ccache/ccache-howto-freebsd.txt for information on using ccache with FreeBSD ports and src. UNFLAVORED devel/binutils -> use devel/binutils@native SUCCEEDED 00:00:15 ------------------------------------------------------------------------------- -- Phase: check-sanity ------------------------------------------------------------------------------- SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: pkg-depends ------------------------------------------------------------------------------- ===> packmol-18.169_1 depends on file: /usr/local/sbin/pkg - found SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: fetch-depends ------------------------------------------------------------------------------- SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: fetch ------------------------------------------------------------------------------- ===> packmol-18.169_1 depends on file: /usr/local/sbin/pkg - found ===> Fetching all distfiles required by packmol-18.169_1 for building SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: checksum ------------------------------------------------------------------------------- ===> packmol-18.169_1 depends on file: /usr/local/sbin/pkg - found ===> Fetching all distfiles required by packmol-18.169_1 for building => SHA256 Checksum OK for mcubeg-packmol-18.169_GH0.tar.gz. SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: extract-depends ------------------------------------------------------------------------------- SUCCEEDED 00:00:01 ------------------------------------------------------------------------------- -- Phase: extract ------------------------------------------------------------------------------- ===> packmol-18.169_1 depends on file: /usr/local/sbin/pkg - found ===> Fetching all distfiles required by packmol-18.169_1 for building ===> Extracting for packmol-18.169_1 => SHA256 Checksum OK for mcubeg-packmol-18.169_GH0.tar.gz. Extracted Memory Use: 0.75M SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: patch-depends ------------------------------------------------------------------------------- SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: patch ------------------------------------------------------------------------------- ===> Patching for packmol-18.169_1 SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: build-depends ------------------------------------------------------------------------------- ===> packmol-18.169_1 depends on file: /usr/local/bin/cmake - found ===> packmol-18.169_1 depends on executable: gfortran12 - found ===> packmol-18.169_1 depends on file: /usr/local/bin/as - found ===> packmol-18.169_1 depends on file: /usr/local/bin/ccache - found SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: lib-depends ------------------------------------------------------------------------------- SUCCEEDED 00:00:00 ------------------------------------------------------------------------------- -- Phase: configure ------------------------------------------------------------------------------- ===> packmol-18.169_1 depends on file: /usr/local/bin/cmake - found ===> packmol-18.169_1 depends on executable: gfortran12 - found ===> packmol-18.169_1 depends on file: /usr/local/bin/as - found ===> packmol-18.169_1 depends on file: /usr/local/bin/ccache - found ===> Configuring for packmol-18.169_1 ===> Performing out-of-source build /bin/mkdir -p /construction/science/packmol/.build CMake Deprecation Warning at CMakeLists.txt:1 (cmake_minimum_required): Compatibility with CMake < 2.8.12 will be removed from a future version of CMake. Update the VERSION argument value or use a ... suffix to tell CMake that the project does not need compatibility with older versions. -- The Fortran compiler identification is GNU 12.2.0 -- Detecting Fortran compiler ABI info -- Detecting Fortran compiler ABI info - done -- Check for working Fortran compiler: /usr/local/bin/gfortran12 - skipped -- Configuring done (1.0s) -- Generating done (0.0s) CMake Warning: Manually-specified variables were not used by the project: CMAKE_CXX_COMPILER CMAKE_CXX_FLAGS CMAKE_CXX_FLAGS_DEBUG CMAKE_CXX_FLAGS_RELEASE CMAKE_C_COMPILER CMAKE_C_FLAGS CMAKE_C_FLAGS_DEBUG CMAKE_C_FLAGS_RELEASE CMAKE_MODULE_LINKER_FLAGS CMAKE_SHARED_LINKER_FLAGS FETCHCONTENT_FULLY_DISCONNECTED THREADS_HAVE_PTHREAD_ARG -- Build files have been written to: /construction/science/packmol/.build SUCCEEDED 00:00:01 ------------------------------------------------------------------------------- -- Phase: build ------------------------------------------------------------------------------- ===> Building for packmol-18.169_1 /usr/local/bin/cmake -S/construction/science/packmol/packmol-18.169 -B/construction/science/packmol/.build --check-build-system CMakeFiles/Makefile.cmake 0 /usr/local/bin/cmake -E cmake_progress_start /construction/science/packmol/.build/CMakeFiles /construction/science/packmol/.build//CMakeFiles/progress.marks /usr/bin/make -f CMakeFiles/Makefile2 all --- CMakeFiles/packmol.dir/all --- /usr/bin/make -f CMakeFiles/packmol.dir/build.make CMakeFiles/packmol.dir/depend --- CMakeFiles/packmol.dir/depend --- cd /construction/science/packmol/.build && /usr/local/bin/cmake -E cmake_depends "Unix Makefiles" /construction/science/packmol/packmol-18.169 /construction/science/packmol/packmol-18.169 /construction/science/packmol/.build /construction/science/packmol/.build /construction/science/packmol/.build/CMakeFiles/packmol.dir/DependInfo.cmake /usr/bin/make -f CMakeFiles/packmol.dir/build.make CMakeFiles/packmol.dir/build --- CMakeFiles/packmol.dir/ahestetic.f90.o --- --- CMakeFiles/packmol.dir/sizes.f90.o --- --- CMakeFiles/packmol.dir/swaptypemod.f90.o --- --- CMakeFiles/packmol.dir/gencan.f.o --- --- CMakeFiles/packmol.dir/strlength.f90.o --- --- CMakeFiles/packmol.dir/setibox.f90.o --- --- CMakeFiles/packmol.dir/flashsort.f90.o --- --- CMakeFiles/packmol.dir/jacobi.f90.o --- --- CMakeFiles/packmol.dir/random.f90.o --- --- CMakeFiles/packmol.dir/ahestetic.f90.o --- [ 2%] Building Fortran object CMakeFiles/packmol.dir/ahestetic.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/ahestetic.f90 -o CMakeFiles/packmol.dir/ahestetic.f90.o --- CMakeFiles/packmol.dir/sizes.f90.o --- [ 5%] Building Fortran object CMakeFiles/packmol.dir/sizes.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/sizes.f90 -o CMakeFiles/packmol.dir/sizes.f90.o --- CMakeFiles/packmol.dir/swaptypemod.f90.o --- [ 7%] Building Fortran object CMakeFiles/packmol.dir/swaptypemod.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/swaptypemod.f90 -o CMakeFiles/packmol.dir/swaptypemod.f90.o --- CMakeFiles/packmol.dir/strlength.f90.o --- [ 10%] Building Fortran object CMakeFiles/packmol.dir/strlength.f90.o --- CMakeFiles/packmol.dir/flashsort.f90.o --- [ 13%] Building Fortran object CMakeFiles/packmol.dir/flashsort.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/flashsort.f90 -o CMakeFiles/packmol.dir/flashsort.f90.o --- CMakeFiles/packmol.dir/swaptypemod.mod.stamp --- /usr/local/bin/cmake -E cmake_copy_f90_mod swaptypemod.mod CMakeFiles/packmol.dir/swaptypemod.mod.stamp GNU --- CMakeFiles/packmol.dir/gencan.f.o --- [ 15%] Building Fortran object CMakeFiles/packmol.dir/gencan.f.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/gencan.f -o CMakeFiles/packmol.dir/gencan.f.o --- CMakeFiles/packmol.dir/swaptypemod.f90.o.provides.build --- /usr/local/bin/cmake -E touch CMakeFiles/packmol.dir/swaptypemod.f90.o.provides.build --- CMakeFiles/packmol.dir/random.f90.o --- [ 18%] Building Fortran object CMakeFiles/packmol.dir/random.f90.o --- CMakeFiles/packmol.dir/strlength.f90.o --- /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/strlength.f90 -o CMakeFiles/packmol.dir/strlength.f90.o --- CMakeFiles/packmol.dir/random.f90.o --- /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/random.f90 -o CMakeFiles/packmol.dir/random.f90.o --- CMakeFiles/packmol.dir/setibox.f90.o --- [ 21%] Building Fortran object CMakeFiles/packmol.dir/setibox.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/setibox.f90 -o CMakeFiles/packmol.dir/setibox.f90.o --- CMakeFiles/packmol.dir/gencan.f.o --- f951: Warning: Nonconforming tab character in column 1 of line 2193 [-Wtabs] --- CMakeFiles/packmol.dir/jacobi.f90.o --- [ 23%] Building Fortran object CMakeFiles/packmol.dir/jacobi.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/jacobi.f90 -o CMakeFiles/packmol.dir/jacobi.f90.o --- CMakeFiles/packmol.dir/gencan.f.o --- /construction/science/packmol/packmol-18.169/gencan.f:5672:72: 5672 | 95 SUM = SUM + DX(J)**2 | 1 Warning: Fortran 2018 deleted feature: DO termination statement which is not END DO or CONTINUE with label 95 at (1) /construction/science/packmol/packmol-18.169/gencan.f:2574:5: 2574 | 1003 format(6X,I6,T22,D17.6,T43,D17.6) | 1 Warning: Label 1003 at (1) defined but not used [-Wunused-label] /construction/science/packmol/packmol-18.169/gencan.f:5662:5: 5662 | 110 IF (DABS(DX(I)).LE.XMAX) GO TO 115 | 1 Warning: Label 110 at (1) defined but not used [-Wunused-label] /construction/science/packmol/packmol-18.169/gencan.f:5661:5: 5661 | 70 IF (DABS(DX(I)).GT.CUTLO) GO TO 75 | 1 Warning: Label 70 at (1) defined but not used [-Wunused-label] /construction/science/packmol/packmol-18.169/gencan.f:5654:5: 5654 | 50 IF (DX(I).EQ.ZERO) GO TO 200 | 1 Warning: Label 50 at (1) defined but not used [-Wunused-label] /construction/science/packmol/packmol-18.169/gencan.f:5652:5: 5652 | 30 IF (DABS(DX(I)).GT.CUTLO) GO TO 85 | 1 Warning: Label 30 at (1) defined but not used [-Wunused-label] /construction/science/packmol/packmol-18.169/gencan.f:62:37: 62 | subroutine evalnal(n,x,m,lambda,rho,g,flag) | 1 Warning: Unused dummy argument 'lambda' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:62:41: 62 | subroutine evalnal(n,x,m,lambda,rho,g,flag) | 1 Warning: Unused dummy argument 'rho' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:2585:40: 2585 | +steabs,epsrel,epsabs,infrel,infabs) | 1 Warning: Unused dummy argument 'infabs' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:2585:33: 2585 | +steabs,epsrel,epsabs,infrel,infabs) | 1 Warning: Unused dummy argument 'infrel' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:2585:12: 2585 | +steabs,epsrel,epsabs,infrel,infabs) | 1 Warning: Unused dummy argument 'steabs' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:2584:71: 2584 | +fmin,maxfc,iprint,fcnt,inform,xtrial,d,gamma,sigma1,sigma2,sterel, | 1 Warning: Unused dummy argument 'sterel' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:3819:61: 3819 | +sigma1,sigma2,sterel,steabs,epsrel,epsabs,infrel,infabs) | 1 Warning: Unused dummy argument 'infabs' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:3819:54: 3819 | +sigma1,sigma2,sterel,steabs,epsrel,epsabs,infrel,infabs) | 1 Warning: Unused dummy argument 'infrel' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:4:36: 4 | subroutine evalal(n,x,m,lambda,rho,f,flag) | 1 Warning: Unused dummy argument 'lambda' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:4:40: 4 | subroutine evalal(n,x,m,lambda,rho,f,flag) | 1 Warning: Unused dummy argument 'rho' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:2981:19: 2981 | +epsabs,infrel,infabs) | 1 Warning: Unused dummy argument 'infrel' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:5179:19: 5179 | +steabs,inform) | 1 Warning: Unused dummy argument 'inform' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:5178:52: 5178 | subroutine calchd(nind,ind,x,d,g,n,xc,m,lambda,rho,hd,xtmp,sterel, | 1 Warning: Unused dummy argument 'lambda' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:5178:56: 5178 | subroutine calchd(nind,ind,x,d,g,n,xc,m,lambda,rho,hd,xtmp,sterel, | 1 Warning: Unused dummy argument 'rho' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:5179:12: 5179 | +steabs,inform) | 1 Warning: Unused dummy argument 'steabs' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:5178:71: 5178 | subroutine calchd(nind,ind,x,d,g,n,xc,m,lambda,rho,hd,xtmp,sterel, | 1 Warning: Unused dummy argument 'sterel' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:5178:64: 5178 | subroutine calchd(nind,ind,x,d,g,n,xc,m,lambda,rho,hd,xtmp,sterel, | 1 Warning: Unused dummy argument 'xtmp' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:125:25: 125 | subroutine evalhd(n) | 1 Warning: Unused dummy argument 'n' at (1) [-Wunused-dummy-argument] /construction/science/packmol/packmol-18.169/gencan.f:525:37: 525 | double precision lastgpns(tmax) | 1 Warning: Array 'lastgpns' at (1) is larger than limit set by '-fmax-stack-var-size=', moved from stack to static storage. This makes the procedure unsafe when called recursively, or concurrently from multiple threads. Consider increasing the '-fmax-stack-var-size=' limit (or use '-frecursive', which implies unlimited '-fmax-stack-var-size') - or change the code to use an ALLOCATABLE array. If the variable is never accessed concurrently, this warning can be ignored, and the variable could also be declared with the SAVE attribute. [-Wsurprising] --- CMakeFiles/packmol.dir/sizes.mod.stamp --- /usr/local/bin/cmake -E cmake_copy_f90_mod sizes.mod CMakeFiles/packmol.dir/sizes.mod.stamp GNU --- CMakeFiles/packmol.dir/comparegrad.f90.o --- --- CMakeFiles/packmol.dir/compute_data.f90.o --- --- CMakeFiles/packmol.dir/flashmod.f90.o --- --- CMakeFiles/packmol.dir/input.f90.o --- --- CMakeFiles/packmol.dir/sizes.f90.o.provides.build --- --- CMakeFiles/packmol.dir/usegencan.f90.o --- --- CMakeFiles/packmol.dir/sizes.f90.o.provides.build --- /usr/local/bin/cmake -E touch CMakeFiles/packmol.dir/sizes.f90.o.provides.build --- CMakeFiles/packmol.dir/flashmod.f90.o --- [ 26%] Building Fortran object CMakeFiles/packmol.dir/flashmod.f90.o --- CMakeFiles/packmol.dir/compute_data.f90.o --- [ 34%] Building Fortran object CMakeFiles/packmol.dir/compute_data.f90.o --- CMakeFiles/packmol.dir/comparegrad.f90.o --- [ 34%] Building Fortran object CMakeFiles/packmol.dir/comparegrad.f90.o --- CMakeFiles/packmol.dir/usegencan.f90.o --- [ 34%] Building Fortran object CMakeFiles/packmol.dir/usegencan.f90.o --- CMakeFiles/packmol.dir/flashmod.f90.o --- /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/flashmod.f90 -o CMakeFiles/packmol.dir/flashmod.f90.o --- CMakeFiles/packmol.dir/compute_data.f90.o --- /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/compute_data.f90 -o CMakeFiles/packmol.dir/compute_data.f90.o --- CMakeFiles/packmol.dir/comparegrad.f90.o --- /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/comparegrad.f90 -o CMakeFiles/packmol.dir/comparegrad.f90.o --- CMakeFiles/packmol.dir/usegencan.f90.o --- /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/usegencan.f90 -o CMakeFiles/packmol.dir/usegencan.f90.o --- CMakeFiles/packmol.dir/input.f90.o --- [ 36%] Building Fortran object CMakeFiles/packmol.dir/input.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/input.f90 -o CMakeFiles/packmol.dir/input.f90.o --- CMakeFiles/packmol.dir/usegencan.mod.stamp --- /usr/local/bin/cmake -E cmake_copy_f90_mod usegencan.mod CMakeFiles/packmol.dir/usegencan.mod.stamp GNU --- CMakeFiles/packmol.dir/compute_data.mod.stamp --- /usr/local/bin/cmake -E cmake_copy_f90_mod compute_data.mod CMakeFiles/packmol.dir/compute_data.mod.stamp GNU --- CMakeFiles/packmol.dir/usegencan.f90.o.provides.build --- /usr/local/bin/cmake -E touch CMakeFiles/packmol.dir/usegencan.f90.o.provides.build --- CMakeFiles/packmol.dir/comprest.f90.o --- --- CMakeFiles/packmol.dir/compute_data.f90.o.provides.build --- --- CMakeFiles/packmol.dir/fparc.f90.o --- --- CMakeFiles/packmol.dir/gparc.f90.o --- --- CMakeFiles/packmol.dir/gwalls.f90.o --- --- CMakeFiles/packmol.dir/polartocart.f90.o --- --- CMakeFiles/packmol.dir/compute_data.f90.o.provides.build --- /usr/local/bin/cmake -E touch CMakeFiles/packmol.dir/compute_data.f90.o.provides.build --- CMakeFiles/packmol.dir/resetboxes.f90.o --- --- CMakeFiles/packmol.dir/polartocart.f90.o --- [ 42%] Building Fortran object CMakeFiles/packmol.dir/polartocart.f90.o --- CMakeFiles/packmol.dir/gparc.f90.o --- [ 42%] Building Fortran object CMakeFiles/packmol.dir/gparc.f90.o --- CMakeFiles/packmol.dir/fparc.f90.o --- [ 44%] Building Fortran object CMakeFiles/packmol.dir/fparc.f90.o --- CMakeFiles/packmol.dir/polartocart.f90.o --- /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/polartocart.f90 -o CMakeFiles/packmol.dir/polartocart.f90.o --- CMakeFiles/packmol.dir/restmol.f90.o --- --- CMakeFiles/packmol.dir/gparc.f90.o --- /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/gparc.f90 -o CMakeFiles/packmol.dir/gparc.f90.o --- CMakeFiles/packmol.dir/fparc.f90.o --- /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/fparc.f90 -o CMakeFiles/packmol.dir/fparc.f90.o --- CMakeFiles/packmol.dir/comprest.f90.o --- [ 50%] Building Fortran object CMakeFiles/packmol.dir/comprest.f90.o --- CMakeFiles/packmol.dir/gwalls.f90.o --- [ 50%] Building Fortran object CMakeFiles/packmol.dir/gwalls.f90.o --- CMakeFiles/packmol.dir/comprest.f90.o --- /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/comprest.f90 -o CMakeFiles/packmol.dir/comprest.f90.o --- CMakeFiles/packmol.dir/gwalls.f90.o --- /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/gwalls.f90 -o CMakeFiles/packmol.dir/gwalls.f90.o --- CMakeFiles/packmol.dir/resetboxes.f90.o --- [ 52%] Building Fortran object CMakeFiles/packmol.dir/resetboxes.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/resetboxes.f90 -o CMakeFiles/packmol.dir/resetboxes.f90.o --- CMakeFiles/packmol.dir/restmol.f90.o --- [ 55%] Building Fortran object CMakeFiles/packmol.dir/restmol.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/restmol.f90 -o CMakeFiles/packmol.dir/restmol.f90.o --- CMakeFiles/packmol.dir/setijk.f90.o --- [ 57%] Building Fortran object CMakeFiles/packmol.dir/setijk.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/setijk.f90 -o CMakeFiles/packmol.dir/setijk.f90.o --- CMakeFiles/packmol.dir/tobar.f90.o --- [ 60%] Building Fortran object CMakeFiles/packmol.dir/tobar.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/tobar.f90 -o CMakeFiles/packmol.dir/tobar.f90.o --- CMakeFiles/packmol.dir/input.mod.stamp --- /usr/local/bin/cmake -E cmake_copy_f90_mod input.mod CMakeFiles/packmol.dir/input.mod.stamp GNU --- CMakeFiles/packmol.dir/flashsort.mod.stamp --- /usr/local/bin/cmake -E cmake_copy_f90_mod flashsort.mod CMakeFiles/packmol.dir/flashsort.mod.stamp GNU --- CMakeFiles/packmol.dir/cenmass.f90.o --- --- CMakeFiles/packmol.dir/computef.f90.o --- --- CMakeFiles/packmol.dir/cenmass.f90.o --- [ 63%] Building Fortran object CMakeFiles/packmol.dir/cenmass.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/cenmass.f90 -o CMakeFiles/packmol.dir/cenmass.f90.o --- CMakeFiles/packmol.dir/computef.f90.o --- [ 65%] Building Fortran object CMakeFiles/packmol.dir/computef.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/computef.f90 -o CMakeFiles/packmol.dir/computef.f90.o --- CMakeFiles/packmol.dir/computeg.f90.o --- --- CMakeFiles/packmol.dir/getinp.f90.o --- --- CMakeFiles/packmol.dir/computeg.f90.o --- [ 68%] Building Fortran object CMakeFiles/packmol.dir/computeg.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/computeg.f90 -o CMakeFiles/packmol.dir/computeg.f90.o --- CMakeFiles/packmol.dir/input.f90.o.provides.build --- /usr/local/bin/cmake -E touch CMakeFiles/packmol.dir/input.f90.o.provides.build --- CMakeFiles/packmol.dir/getinp.f90.o --- [ 71%] Building Fortran object CMakeFiles/packmol.dir/getinp.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/getinp.f90 -o CMakeFiles/packmol.dir/getinp.f90.o --- CMakeFiles/packmol.dir/output.f90.o --- [ 73%] Building Fortran object CMakeFiles/packmol.dir/output.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/output.f90 -o CMakeFiles/packmol.dir/output.f90.o --- CMakeFiles/packmol.dir/pgencan.f90.o --- [ 76%] Building Fortran object CMakeFiles/packmol.dir/pgencan.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/pgencan.f90 -o CMakeFiles/packmol.dir/pgencan.f90.o --- CMakeFiles/packmol.dir/flashmod.f90.o.provides.build --- /usr/local/bin/cmake -E touch CMakeFiles/packmol.dir/flashmod.f90.o.provides.build --- CMakeFiles/packmol.dir/setsizes.f90.o --- [ 78%] Building Fortran object CMakeFiles/packmol.dir/setsizes.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/setsizes.f90 -o CMakeFiles/packmol.dir/setsizes.f90.o --- CMakeFiles/packmol.dir/ahestetic.mod.stamp --- /usr/local/bin/cmake -E cmake_copy_f90_mod ahestetic.mod CMakeFiles/packmol.dir/ahestetic.mod.stamp GNU --- CMakeFiles/packmol.dir/ahestetic.f90.o.provides.build --- /usr/local/bin/cmake -E touch CMakeFiles/packmol.dir/ahestetic.f90.o.provides.build --- CMakeFiles/packmol.dir/checkpoint.f90.o --- --- CMakeFiles/packmol.dir/heuristics.f90.o --- --- CMakeFiles/packmol.dir/checkpoint.f90.o --- [ 81%] Building Fortran object CMakeFiles/packmol.dir/checkpoint.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/checkpoint.f90 -o CMakeFiles/packmol.dir/checkpoint.f90.o --- CMakeFiles/packmol.dir/heuristics.f90.o --- [ 84%] Building Fortran object CMakeFiles/packmol.dir/heuristics.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/heuristics.f90 -o CMakeFiles/packmol.dir/heuristics.f90.o --- CMakeFiles/packmol.dir/initial.f90.o --- [ 86%] Building Fortran object CMakeFiles/packmol.dir/initial.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/initial.f90 -o CMakeFiles/packmol.dir/initial.f90.o --- CMakeFiles/packmol.dir/packmol.f90.o --- [ 89%] Building Fortran object CMakeFiles/packmol.dir/packmol.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/packmol.f90 -o CMakeFiles/packmol.dir/packmol.f90.o --- CMakeFiles/packmol.dir/swaptype.f90.o --- [ 92%] Building Fortran object CMakeFiles/packmol.dir/swaptype.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/swaptype.f90 -o CMakeFiles/packmol.dir/swaptype.f90.o --- CMakeFiles/packmol.dir/title.f90.o --- [ 94%] Building Fortran object CMakeFiles/packmol.dir/title.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/title.f90 -o CMakeFiles/packmol.dir/title.f90.o --- CMakeFiles/packmol.dir/writesuccess.f90.o --- [ 97%] Building Fortran object CMakeFiles/packmol.dir/writesuccess.f90.o /usr/local/bin/gfortran12 -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall -c /construction/science/packmol/packmol-18.169/writesuccess.f90 -o CMakeFiles/packmol.dir/writesuccess.f90.o --- CMakeFiles/packmol.dir/output.f90.o --- /construction/science/packmol/packmol-18.169/output.f90:552:32: 552 | nres = ilres - ifres + 1 | ^ Warning: 'ilres' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/output.f90:17:53: 17 | irest, iimol, ichain, iatom, irec, ilres, ifres,& | ^ note: 'ilres' was declared here --- CMakeFiles/packmol.dir/getinp.f90.o --- /construction/science/packmol/packmol-18.169/getinp.f90:863:11: 863 | if(ires.ne.ireslast) then | ^ Warning: 'ireslast' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/getinp.f90:848:34: 848 | integer :: iread, ires, ireslast, nres, ioerr | ^ note: 'ireslast' was declared here --- CMakeFiles/packmol.dir/packmol.f90.o --- /construction/science/packmol/packmol-18.169/packmol.f90:806:63: 806 | if(flast.gt.0.d0) fimp = -100.d0 * (fx - flast) / flast | ^ Warning: 'flast' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/packmol.f90:59:38: 59 | double precision :: fx, bestf, flast, fprint, all_type_fx | ^ note: 'flast' was declared here /construction/science/packmol/packmol-18.169/packmol.f90:321:50: 321 | iratom(icart,iratcount) = iirest | ^ Warning: 'iirest' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/packmol.f90:49:42: 49 | integer :: i, iline, iiatom, iat, iirest, iratcount, ival | ^ note: 'iirest' was declared here --- CMakeFiles/packmol.dir/gencan.f.o --- /construction/science/packmol/packmol-18.169/gencan.f:3346:72: 3346 | beta = rnorm2 / rnorm2prev | ^ Warning: 'rnorm2prev' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/gencan.f:3238:24: 3238 | + rnorm2prev,snorm2,snorm2prev | ^ note: 'rnorm2prev' was declared here /construction/science/packmol/packmol-18.169/gencan.f:3650:14: 3650 | if ( rbdtype .eq. 1 ) then | ^ Warning: 'rbdposatype' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/gencan.f:3234:68: 3234 | integer i,itnqmp,rbdnegaind,rbdnegatype,rbdposaind,rbdposatype | ^ note: 'rbdposatype' was declared here /construction/science/packmol/packmol-18.169/gencan.f:3643:72: 3643 | rbdind = rbdposaind | ^ Warning: 'rbdposaind' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/gencan.f:3234:56: 3234 | integer i,itnqmp,rbdnegaind,rbdnegatype,rbdposaind,rbdposatype | ^ note: 'rbdposaind' was declared here /construction/science/packmol/packmol-18.169/gencan.f:3353:72: 3353 | + beta ** 2 * dnorm2 | ^ Warning: 'dtw' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/gencan.f:3237:21: 3237 | + dts,dtw,gnorm2,gts,norm2s,q,qamax,qamaxn,qprev,rnorm2, | ^ note: 'dtw' was declared here /construction/science/packmol/packmol-18.169/gencan.f:3353:72: 3353 | + beta ** 2 * dnorm2 | ^ Warning: 'dtr' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/gencan.f:3236:71: 3236 | + amax2nx,amax2x,bb,bestprog,beta,cc,currprog,dd,dnorm2,dtr, | ^ note: 'dtr' was declared here /construction/science/packmol/packmol-18.169/gencan.f:3353:72: 3353 | + beta ** 2 * dnorm2 | ^ Warning: 'dnorm2' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/gencan.f:3236:67: 3236 | + amax2nx,amax2x,bb,bestprog,beta,cc,currprog,dd,dnorm2,dtr, | ^ note: 'dnorm2' was declared here /construction/science/packmol/packmol-18.169/gencan.f:3495:72: 3495 | amaxn = max( amax1n, amax2n ) | ^ Warning: 'amax1n' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/gencan.f:3235:49: 3235 | double precision aa,alpha,amax,amax1,amax1n,amaxn,amax2,amax2n, | ^ note: 'amax1n' was declared here /construction/science/packmol/packmol-18.169/gencan.f:3494:72: 3494 | amax = min( amax1 , amax2 ) | ^ Warning: 'amax1' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/gencan.f:3235:42: 3235 | double precision aa,alpha,amax,amax1,amax1n,amaxn,amax2,amax2n, | ^ note: 'amax1' was declared here /construction/science/packmol/packmol-18.169/gencan.f:3353:72: 3353 | + beta ** 2 * dnorm2 | ^ Warning: 'alpha' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/gencan.f:3235:31: 3235 | double precision aa,alpha,amax,amax1,amax1n,amaxn,amax2,amax2n, | ^ note: 'alpha' was declared here /construction/science/packmol/packmol-18.169/gencan.f:2074:72: 2074 | lamspg = sts / sty | ^ Warning: 'sty' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/gencan.f:1677:41: 1677 | + kappa,lamspg,ometa2,sts,sty,xnorm | ^ note: 'sty' was declared here /construction/science/packmol/packmol-18.169/gencan.f:2137:72: 2137 | delta = max( delmin, 10.0d0 * sqrt( sts ) ) | ^ Warning: 'sts' may be used uninitialized [-Wmaybe-uninitialized] /construction/science/packmol/packmol-18.169/gencan.f:1677:37: 1677 | + kappa,lamspg,ometa2,sts,sty,xnorm | ^ note: 'sts' was declared here --- packmol --- [100%] Linking Fortran executable packmol /usr/local/bin/cmake -E cmake_link_script CMakeFiles/packmol.dir/link.txt --verbose=1 /usr/local/bin/gfortran12 -Wl,-rpath=/usr/local/lib/gcc12 -L/usr/local/lib/gcc12 -B/usr/local/bin -O -Wl,-rpath=/usr/local/lib/gcc12 -Wall CMakeFiles/packmol.dir/cenmass.f90.o CMakeFiles/packmol.dir/gencan.f.o CMakeFiles/packmol.dir/pgencan.f90.o CMakeFiles/packmol.dir/initial.f90.o CMakeFiles/packmol.dir/title.f90.o 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