root@ethene-X9DBL-3F-X9DBL-iF:~/qm-software/columbus/columbus# bash ./install.automatic -p linux64.ifc standard install.automatic bash version 06/2010 (tm) install will not extract the source code, hence it must have been extracted before packageid STANDARD cannot find compress Using $COLUMBUS/colperl as perl interpreter ============================ settings : CPPL = cpp -C -E -traditional : PERL = /root/qm-software/columbus/columbus/Columbus/colperl : RANLIB = /usr/bin/ranlib : GMAKE = gmake : GREP = /bin/grep : TAR = /bin/tar : GUNZIP = /bin/gunzip : BLASLIBRARY = -Wl,--start-group ${MKLROOT}/lib/intel64/libmkl_intel_ilp64.a ${MKLROOT}/lib/intel64/libmkl_core.a ${MKLROOT}/lib/intel64/libmkl_sequential.a -Wl,--end-group -lpthread -lm -ldl : LAPACKLIBRARY = -Wl,--start-group ${MKLROOT}/lib/intel64/libmkl_intel_ilp64.a ${MKLROOT}/lib/intel64/libmkl_core.a ${MKLROOT}/lib/intel64/libmkl_sequential.a -Wl,--end-group -lpthread -lm -ldl : COLUMBUS = /root/qm-software/columbus/columbus/Columbus : DALTON = /root/qm-software/columbus/columbus/Columbus/source/dalton : DALTON2 = : GACOMMUNICATION = MPI : MPI_MAINDIR = /usr/license/intel/impi/5.0.3.049/intel64 : MPI_LIBS = /usr/license/intel/impi/5.0.3.049/intel64/lib/libmpi.a : MPI_STARTUP = /usr/license/intel/impi/5.0.3.049/intel64/bin/mpirun -np _NPROC_ _EXE_ _EXEOPTS_ : PSCRIPT = : MPI_FC = /usr/license/intel/impi/5.0.3.049/intel64/bin/mpiifort -z muldefs : MPI_LD = mpiifort -z muldefs : MPI_CC = /usr/license/intel/impi/5.0.3.049/intel64/bin/mpiicc : MOLCAS = : VMOLCAS = : PMOLCAS = : MCFLAGS = : INSTALLOPTION = NOGA_INSTALL : COLUMBUSVERSION = 7.0 : GAVERSION = GA53 ============================ ---------- configuration file Columbus/machine.cfg/linux64.ifc ------------------ FORTRAN=ifort -c -nowarn -mkl=sequential FFLAGS= -i8 -O2 FFLAGSCARE= -i8 -O0 -g -noautomatic FFLAGS2= -i8 -O2 -noautomatic CFLAGS= -DLINUX -DBIT64 -DINT64 CXX=icpc -c CC=gcc -c -O $(CFLAGS) CCMOLDEN=gcc -c -DDOBACK -DHASTIMER -DCOLOR_OFFSET=0.0 LOADER=ifort -z muldefs MOLDENLIBS= -L/usr/X11R6/lib -lX11 -lm AR=ar rv ARX=ar x CPPDIR=-I$(DALTON_DIR)/include -DCOLUMBUS -DSYS_LINUX -DPTR64 -Df90 -DVAR_BLAS3 -DINT64 SPEC=$(COLUMBUS)/special/UNIX KOPC=$(SPEC)/fdate.c $(SPEC)/fwtime.c $(SPEC)/hostnm.c \ $(SPEC)/flushstdout.c $(SPEC)/fsize.c $(SPEC)/getputvec.c $(SPEC)/workdir.c CDEF=icc -c -DFLUSH -DINT64 -DEXTNAME -I$(SPEC) YES=1 FIXED=-fixed FREE=-free OBJECTSCARE=mcscf8.o gdiis.o givens.o suscal.o transmo.o polyhes.o utilities.o dzero.o OBJECTSCAREFREE= ciudg_loop.o potentialmodfree.o potenrg.o BLASCONVERSION=StoDblas KEYWORDS=jsc:unix:linux:milstd1753:bit64:format:blas2:blas3:pipemode:f90:f95:int64:molcas_int64:noenvsupport:shavittgraph:ga50:molcas_label10 DKEYWORDS=-DJSC -DUNIX -DLINUX -DMILSTD1753 -DBIT64 -DFORMATDOLLAR -DBLAS2 -DBLAS3 -DPIPEMODE -DF90 -DF95 -DINT64 -DMOLCAS_INT64 -DNOENVSUPPORT -DGA50 -DMOLCAS_LABEL10 DALTON2CPP=-DRCLU4 -DVAR_IFC -DSYS_LINUX -D_FILE_OFFSET_BITS=64 -DVAR_MFDS -DIMPLICIT_NONE MOLCASFF=$(FFLAGS) PARALLELKEYS=parallel:mpi DPARALLELKEYS=-DPARALLEL -DMPI MOLCASKEYS=molcas:molcas_int64 DMOLCASKEYS=-DMOLCAS -DMOLCAS_INT64 STATIC=-static -static-libgcc ------------------------------------------------------------------------ standard.tar /root/qm-software/columbus/columbus/install.log.standard starting installation of standard package path= /root/qm-software/columbus/columbus/Columbus ls: cannot access '../filepp': No such file or directory /root/qm-software/columbus/columbus/Columbus/colperl: error while loading shared libraries: libncursesw.so.5: cannot open shared object file: No such file or directory cp: cannot stat '/root/qm-software/columbus/columbus/Columbus/source/potential/pot_reduce.py': No such file or directory /root/qm-software/columbus/columbus/Columbus/colperl: error while loading shared libraries: libncursesw.so.5: cannot open shared object file: No such file or directory installation of standard package failed check /root/qm-software/columbus/columbus/install.log.standard for details root@ethene-X9DBL-3F-X9DBL-iF:~/qm-software/columbus/columbus#