[molpro-user] update: error during make install -> swapdisks
Benj FitzPatrick
benjfitz at uchicago.edu
Thu Nov 30 15:55:01 GMT 2006
Hello,
I get this error with the pathscale 2.5 compiler as well and
patch level 49. To give some more info I included my CONFIG
file below, though this is pretty much the same one I've been
using since 2006.1 came out and it has always worked before.
Thanks,
Benj FitzPatrick
Butler Group
University of Chicago
# MOLPRO CONFIG generated at Tue May 2 19:44:30 CDT 2006 with
version 2002.10
# for host benjfitz.uchicago.edu, architecture
unix unix-i8 unix-linux unix-linux-x86_64
#
# insert additional hosts before benjfitz.uchicago.edu in
above line, if desired
#
ARCHITECTURE="unix unix-i8 unix-linux unix-linux-x86_64 mpp"
# Compilers ..
CC="/opt/pathscale/bin/pathcc -DI64 -m64"
FC="/opt/pathscale/bin/pathf90 -i8 -fno-second-underscore
-woff -align64"
F90="/opt/pathscale/bin/pathf90 -i8 -fno-second-underscore
-woff -align64"
# compiler command to be used only when linking molpro.exe ..
eg mpxlf on IBM SP
LINKFC="/opt/pathscale/bin/pathf90 -i8 -fno-second-underscore
-woff -align64"
YACC="bison -b y"
ARFLAGS="-r"
PERL="1"
PERLEXE="/usr/bin/perl"
PERLVERSION="5.008008"
# C defines
# nb SEEK is disk seek speed in seconds
# SPEED is disk transfer rate in 8 bytes/second
# compiler optimisation
COPT="-O2 -OPT:Ofast"
FOPT="-O2 -OPT:Ofast"
# compiler explicit no optimisation
CDEF="-DSEEK=.001 -DSPEED=200000 -DLARGEFILES
-DMPIGM_FORMAT=1 -DZLIB -DHAVE_INTTYPES_H -DMA_ALLOC
-DMOLPROC_PAR"
CNOPT=" "
COPT1="-O1"
COPT2="-O2"
FNOPT="-O0"
FOPT1="-O1"
FOPT2="-O2"
FOPT3="-O3"
# compiler debug flag
CDEBUG="-g"
FDEBUG="-g"
# static variables
FSTATIC=" "
# 64-bit integers
FI64=" "
# profiling
FPROFILE="-p"
CPROFILE="-p"
# additional pre-processor flags
FTCFLAGS="mpp eaf pathf90 blas0 blas1 blas2 blas3 lapack"
# additional directories to be compiled in mpp case
MPPDIR="mpp"
SLATERDIR=""
# additional libraries and link options
LIBS="/usr/lib64/libpthread.so -lz"
LINKOPT="-Wl,-rpath,/opt/pathscale/lib/2.5"
# non-standard location of system libraries
LIBDIR="/ab/ga4.0_large_i8-path-goto1.09-4/lib/LINUX64"
# GKS X-windows library
GKSLIB="-lgks0"
# BLAS library
BLASLIB="-L/ab/libs -lgoto1.09_path_4"
# LAPACK library
LAPACKLIB="-L/ab/libs -llapack_path_goto1.09_4"
# MPP?
MPP="1"
MPPX="0"
SLATER=0
WRAPPER="/ab/ga4.0_large_i8-path-goto1.09-4/tcgmsg/ipcv4.0/parallel"
USE_MPI=""
USE_LAPI=""
USE_MYRINET=""
MPI_LIB=""
MPPNAME="tcgmsg"
ARCHNAME="amd64"
MPITYPE=""
MPIBASEDIR=""
MYRINET_LIB=""
MYRINET_LINKPARS=""
MPIGM_FORMAT="1"
USE_GIO="0"
USE_GATOOLS="0"
# files in src/ to be compiled without optimization
F77VERSION="PathScale EKOPath(TM) Compiler Suite: Version 2.5"
FORTVERSION="path2.5"
NO_OPT=""
F_OPT1="seward/wrone_molpro.f mrci/ciref.f eom/opdom_eom.f"
F_OPT2=""
F_OPT3="dft/dft.f dft/dftfun.f dft/dftgrid.f dft/dfti.f
dft/dftigrad.f dft/dftuser.f dft/dftutil.f dft/gridorb.f
blas/matrix.f blas/matrix1.f blas/utlmar.f util/compress.f
util/util.f scf/hfma.f mrci/kext.f ccsd/cckint.f mrci/cigss.f
mrci/cigps.f mrci/ciutil.f mrci/cid23h.f mrci/ciden23hc.f
mrci/ciden2.f mrci/cigpq1.f mrci/cigpq2.f mrci/cigpq3.f
mrci/cifpp.f mrci/cidps.f mrci/cidss.f mrci/ciden2a.f
mrci/cicon.f blas/mxml1.f blas/mxml1b.f blas/mxml2.f
blas/mxml2b.f blas/mxml3.f blas/mxml3b.f blas/mxml4.f
blas/mxml4b.f blas/mxml5.f blas/mxml5b.f blas/mxml6.f
blas/mxml6b.f blas/mxm.f blas/mxm4.f blas/mxma2_nn.f
blas/mxma2_tn.f blas/mxmdgm.f blas/mxt.f blas/mxm3.f
blas/mxma2.f blas/mxma2_nt.f blas/mxma_mpp.f blas/mxs.f
blas/mxv.f"
C_OPT1=" "
C_OPT2=" "
# ranlib command (if not needed, true)
RANLIB="true"
# ls command to get user and group
LSFULL="ls -l"
# cp -p if it exists, else cp
CP="cp -p"
# tar command
TAR="tar"
# awk command
AWK="awk"
# strip command
STRIP="strip"# installation directories
INSTBIN="/ab/molpro-2006-1/32"
INSTLIB="/ab/molpro-2006-1/32/aux"
INSTHTML=""
INSTCGI=""
# makedepend configuration
MAKEDEPEND_OPTIONS="-u"
MODULE_SUFFIX="mod"
MODULE_FLAG="-I"
# non-default libraries
BLASLIB_x86_64="-L/ab/libs -lgoto1.09_path_4"
LAPACKLIB_x86_64="-L/ab/libs -llapack_path_goto1.09_4"
WRAPPER_tcgmsg=/ab/ga4.0_large_i8-path-goto1.09-4/tcgmsg/ipcv4.0/parallel
PARSE=parse-x86_64-unknown-linux-gnu-i8.o.gz
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