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jglee646

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[交流] 【求助】VASP4.6并行编译出错

我用的操作系统是redhat 5.1 enterprise，编译时出现错误：
No Fortran 90 compiler specified when mpif90 was created,
or configuration file does not specify a compiler.
请问该如何解决？

makefile内容是：
.SUFFIXES: .inc .f .f90 .F
#-----------------------------------------------------------------------
# Makefile for Intel Fortran compiler for P4 systems
#
# The makefile was tested only under Linux on Intel platforms
# (Suse 5.3, libc 6 <-> glibc 2.X)
#
# it might be required to change some of library pathes, since
# LINUX installation vary a lot
# Hence check ***ALL**** options in this makefile very carefully
#-----------------------------------------------------------------------
#
# Mind that some Linux distributions (Suse 6.1) have a bug in
# libm causing small errors in the error-function (total energy
# is therefore wrong by about 1meV/atom). The recommended
# solution is to update libc.
#
# BLAS must be installed on the machine
# there are several options:
# 1) very slow but works:
# retrieve the lapackage from ftp.netlib.org
# and compile the blas routines (BLAS/SRC directory)
# please use g77 or f77 for the compilation. When I tried to
# use pgf77 or pgf90 for BLAS, VASP hang up when calling
# ZHEEV  (however this was with lapack 1.1 now I use lapack 2.0)
# 2) most desirable: get an optimized BLAS
# for a list of optimized BLAS try
#    http://www.kachinatech.com/~hjjou/scilib/opt_blas.html
#
# the two most reliable packages around are presently:
# 3a) Intels own optimised BLAS (PIII, P4, Itanium)
#    http://developer.intel.com/software/products/mkl/
# this is really excellent when you use Intel CPU's
#
# 3b) or obtain the atlas based BLAS routines
#    http://math-atlas.sourceforge.net/
# you certainly need atlas on the Athlon, since the  mkl
# routines are not optimal on the Athlon.
# If you want to use atlas based BLAS, check the lines around LIB=
#
# 3c) brand new and mindblowing fast SSE  (4 GFlops on P4, 2.53 GHz)
# Kazushige Goto's BLAS
# http://www.cs.utexas.edu/users/kgoto/signup_first.html
#
#
#-----------------------------------------------------------------------

# all CPP processed fortran files have the extension .f
SUFFIX=.f90

#-----------------------------------------------------------------------
# fortran compiler and linker
#-----------------------------------------------------------------------
#FC=ifc
# fortran linker
#FCL=$(FC)

#-----------------------------------------------------------------------
# whereis CPP ?? (I need CPP, can't use gcc with proper options)
# that's the location of gcc for SUSE 5.3
#
#  CPP_ =  /usr/lib/gcc-lib/i486-linux/2.7.2/cpp -P -C
#
# that's probably the right line for some Red Hat distribution:
#
#  CPP_ =  /usr/lib/gcc-lib/i386-redhat-linux/2.7.2.3/cpp -P -C
#
#  SUSE X.X, maybe some Red Hat distributions:

CPP_ =  ./preprocess <$*.F | /usr/bin/cpp -P -C -traditional >$*$(SUFFIX)

#-----------------------------------------------------------------------
# possible options for CPP:
# NGXhalf          charge density reduced in X direction
# wNGXhalf          gamma point only reduced in X direction
# avoidalloc       avoid ALLOCATE if possible
# IFC                work around some IFC bugs
# CACHE_SIZE       1000 for PII,PIII, 5000 for Athlon, 8000-12000 P4
# RPROMU_DGEMV       use DGEMV instead of DGEMM in RPRO (usually  faster)
# RACCMU_DGEMV       use DGEMV instead of DGEMM in RACC (faster on P4)
#-----------------------------------------------------------------------

#CPP    = $(CPP_)  -DHOST=\"LinuxIFC\" \
#       -Dkind8 -DNGXhalf -DCACHE_SIZE=12000 -DPGF90 -Davoidalloc \
#       -DRPROMU_DGEMV  -DRACCMU_DGEMV

#-----------------------------------------------------------------------
# general fortran flags  (there must a trailing blank on this line)
#-----------------------------------------------------------------------

FFLAGS =  -FR -lowercase

#-----------------------------------------------------------------------
# optimization
# we have tested whether higher optimisation improves performance
# -xW SSE2 optimization
# -axW  SSE2 optimization,  but also generate code executable on all mach.
# -tpp7 P4 optimization
# -prefetch
#-----------------------------------------------------------------------

OFLAG=-O3 -xW -tpp7

OFLAG_HIGH = $(OFLAG)
OBJ_HIGH =
OBJ_NOOPT =
DEBUG  = -FR -O0
INLINE = $(OFLAG)

#-----------------------------------------------------------------------
# the following lines specify the position of BLAS  and LAPACK
# on P4, VASP works fastest with Intels mkl performance library
# so that's what I recommend
#-----------------------------------------------------------------------

# Atlas based libraries
#ATLASHOME= $(HOME)/archives/BLAS_OPT/ATLAS/lib/Linux_P4SSE2/
#BLAS= -L$(ATLASHOME)  -lf77blas -latlas

# use specific libraries (default library path points to other libraries)
#BLAS= $(ATLASHOME)/libf77blas.a $(ATLASHOME)/libatlas.a

# use the mkl Intel libraries for p4 (www.intel.com)
# mkl.5.1
# set -DRPROMU_DGEMV  -DRACCMU_DGEMV in the CPP lines
BLAS=-L/opt/intel/mkl/9.0/lib/em64t -lmkl_em64t -lguide -lpthread

# mkl.5.2 requires also to -lguide library
# set -DRPROMU_DGEMV  -DRACCMU_DGEMV in the CPP lines
#BLAS=-L/opt/intel/mkl/lib/32 -lmkl_p4 -lguide -lpthread

# even faster Kazushige Goto's BLAS
# http://www.cs.utexas.edu/users/kgoto/signup_first.html
#BLAS=  /opt/libs/libgoto/libgoto_p4_512-r0.6.so

# LAPACK, simplest use vasp.4.lib/lapack_double
#LAPACK= ../vasp.4.lib/lapack_double.o

# use atlas optimized part of lapack
#LAPACK= ../vasp.4.lib/lapack_atlas.o  -llapack -lcblas

# use the mkl Intel lapack
LAPACK=-L/opt/intel/mkl/9.0/lib/em64t -lmkl_lapack -lguide -lpthread

#-----------------------------------------------------------------------

#LIB  = ../vasp.4.lib/libdmy.a \
   ../vasp.4.lib/linpack_double.o $(LAPACK) \
   $(BLAS)

# options for linking (for compiler version 6.X) nothing is required
#LINK =
# compiler version 7.0 generates some vector statments which are located
# in the svml library, add the LIBPATH and the library (just in case)
#LINK =  -L/opt/intel/fce/9.0/lib -lsvml -xW

#-----------------------------------------------------------------------
# fft libraries:
# VASP.4.6 can use fftw.30 (http://www.fftw.org)
# since this version is faster on P4 machines, we recommend to use it
#-----------------------------------------------------------------------

#FFT3D = fft3dfurth.o fft3dlib.o
#FFT3D = fftw3d.o fft3dlib.o /opt/libs/fftw-3.0/lib/libfftw3.a

#=======================================================================
# MPI section, uncomment the following lines
#
# one comment for users of mpich or lam:
# You must *not* compile mpi with g77/f77, because f77/g77
# appends *two* underscores to symbols that contain already an
# underscore (i.e. MPI_SEND becomes mpi_send__).  The pgf90
# compiler however appends only one underscore.
# Precompiled mpi version will also not work !!!
#
# We found that mpich.1.2.1 and lam-6.5.X are stable
# mpich.1.2.1 was configured with
#  ./configure -prefix=/usr/local/mpich_nodvdbg -fc="pgf77 -Mx,119,0x200000"  \
# -f90="pgf90 -Mx,119,0x200000" \
# --without-romio --without-mpe -opt=-O \
#
# lam was configured with the line
#  ./configure  -prefix /usr/local/lam-6.5.X --with-cflags=-O -with-fc=pgf90 \
# --with-f77flags=-O --without-romio
#
# lam was generally faster and we found an average communication
# band with of roughly 160 MBit/s (full duplex)
#
# please note that you might be able to use a lam or mpich version
# compiled with f77/g77, but then you need to add the following
# options: -Msecond_underscore (compilation) and -g77libs (linking)
#
# !!! Please do not send me any queries on how to install MPI, I will
# certainly not answer them !!!!
#=======================================================================
#-----------------------------------------------------------------------
# fortran linker for mpi: if you use LAM and compiled it with the options
# suggested above,  you can use the following line
#-----------------------------------------------------------------------

FC=/hptc_cluster/software/mpich-1.2.7/bin/mpif90
FCL=$(FC)

#-----------------------------------------------------------------------
# additional options for CPP in parallel version (see also above):
# NGZhalf             charge density reduced in Z direction
# wNGZhalf             gamma point only reduced in Z direction
# scaLAPACK          use scaLAPACK (usually slower on 100 Mbit Net)
#-----------------------------------------------------------------------

CPP = $(CPP_) -DMPI  -DHOST=\"LinuxIFC\" -DIFC \
   -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc \
   -DMPI_BLOCK=500 -DPROC_GROUP=8 \
-DRPROMU_DGEMV  -DRACCMU_DGEMV

#-----------------------------------------------------------------------
# location of SCALAPACK
# if you do not use SCALAPACK simply uncomment the line SCA
#-----------------------------------------------------------------------

BLACS=$(HOME)/archives/SCALAPACK/BLACS/
SCA_=$(HOME)/archives/SCALAPACK/SCALAPACK

#SCA= $(SCA_)/libscalapack.a  \
# $(BLACS)/LIB/blacsF77init_MPI-LINUX-0.a $(BLACS)/LIB/blacs_MPI-LINUX-0.a $(BLACS)/LIB/blacsF77init_MPI-LINUX-0.a

#SCA=

#-----------------------------------------------------------------------
# libraries for mpi
#-----------------------------------------------------------------------

LIB    = -L../vasp.4.lib -ldmy  \
   ../vasp.4.lib/linpack_double.o $(LAPACK) \
   $(SCA) $(BLAS)

# FFT: fftmpi.o with fft3dlib of Juergen Furthmueller
FFT3D = fftmpi.o fftmpi_map.o fft3dlib.o

# fftw.3.0 is slighly faster and should be used if available
#FFT3D = fftmpiw.o fftmpi_map.o fft3dlib.o /usr/local/fftw/lib/libfftw3.a

#-----------------------------------------------------------------------
# general rules and compile lines
#-----------------------------------------------------------------------
BASIC= symmetry.o symlib.o lattlib.o  random.o

SOURCE=  base.o    mpi.o    smart_allocate.o    xml.o  \
      constant.o jacobi.o main_mpi.o  scala.o \
      asa.o    lattice.o  poscar.o ini.o    setex.o    radial.o  \
      pseudo.o mgrid.o mkpoints.o wave.o    wave_mpi.o  $(BASIC) \
      nonl.o    nonlr.o dfast.o choleski2.o \
      mix.o    charge.o xcgrad.o xcspin.o potex1.o potex2.o  \
      metagga.o  constrmag.o pot.o    cl_shift.o force.o dos.o    elf.o    \
      tet.o    hamil.o steep.o dimer.o  dynmat.o  neb.o  lanczos.o  instanton.o  \
      sd.o    cg.o    qm.o    lbfgs.o  bfgs.o  fire.o opt.o \
      chain.o dyna.o    relativistic.o LDApU.o sphpro.o  paw.o us.o \
      ebs.o    wavpre.o wavpre_noio.o broyden.o \
      dynbr.o rmm-diis.o reader.o writer.o tutor.o xml_writer.o \
      brent.o stufak.o fileio.o opergrid.o stepver.o  \
      dipol.o xclib.o chgloc.o subrot.o optreal.o davidson.o \
      edtest.o electron.o shm.o    pardens.o  paircorrection.o \
      optics.o constr_cell_relax.o stm.o finite_diff.o \
      elpol.o setlocalpp.o

INC=

vasp: $(SOURCE) $(FFT3D) $(INC) main.o
rm -f vasp
$(FCL) -o vasp $(LINK) main.o  $(SOURCE) $(FFT3D) $(LIB)
makeparam: $(SOURCE) $(FFT3D) makeparam.o main.F $(INC)
$(FCL) -o makeparam  $(LINK) makeparam.o $(SOURCE) $(FFT3D) $(LIB)
zgemmtest: zgemmtest.o base.o random.o $(INC)
$(FCL) -o zgemmtest $(LINK) zgemmtest.o random.o base.o $(LIB)
dgemmtest: dgemmtest.o base.o random.o $(INC)
$(FCL) -o dgemmtest $(LINK) dgemmtest.o random.o base.o $(LIB)
ffttest: base.o smart_allocate.o mpi.o mgrid.o random.o ffttest.o $(FFT3D) $(INC)
$(FCL) -o ffttest $(LINK) ffttest.o mpi.o mgrid.o random.o smart_allocate.o base.o $(FFT3D) $(LIB)
kpoints: $(SOURCE) $(FFT3D) makekpoints.o main.F $(INC)
$(FCL) -o kpoints $(LINK) makekpoints.o $(SOURCE) $(FFT3D) $(LIB)

clean:
-rm -f *.f *.o *.L ; touch *.F

main.o: main$(SUFFIX)
$(FC) $(FFLAGS)$(DEBUG)  $(INCS) -c main$(SUFFIX)
xcgrad.o: xcgrad$(SUFFIX)
$(FC) $(FFLAGS) $(INLINE)  $(INCS) -c xcgrad$(SUFFIX)
xcspin.o: xcspin$(SUFFIX)
$(FC) $(FFLAGS) $(INLINE)  $(INCS) -c xcspin$(SUFFIX)

makeparam.o: makeparam$(SUFFIX)
$(FC) $(FFLAGS)$(DEBUG)  $(INCS) -c makeparam$(SUFFIX)

makeparam$(SUFFIX): makeparam.F main.F
#
# MIND: I do not have a full dependency list for the include
# and MODULES: here are only the minimal basic dependencies
# if one strucuture is changed then touch_dep must be called
# with the corresponding name of the structure
#
base.o: base.inc base.F
mgrid.o: mgrid.inc mgrid.F
constant.o: constant.inc constant.F
lattice.o: lattice.inc lattice.F
setex.o: setexm.inc setex.F
pseudo.o: pseudo.inc pseudo.F
poscar.o: poscar.inc poscar.F
mkpoints.o: mkpoints.inc mkpoints.F
wave.o: wave.inc wave.F
nonl.o: nonl.inc nonl.F
nonlr.o: nonlr.inc nonlr.F

$(OBJ_HIGH):
$(CPP)
$(FC) $(FFLAGS) $(OFLAG_HIGH) $(INCS) -c $*$(SUFFIX)
$(OBJ_NOOPT):
$(CPP)
$(FC) $(FFLAGS) $(INCS) -c $*$(SUFFIX)

fft3dlib_f77.o: fft3dlib_f77.F
$(CPP)
$(F77) $(FFLAGS_F77) -c $*$(SUFFIX)

.F.o:
$(CPP)
$(FC) $(FFLAGS) $(OFLAG) $(INCS) -c $*$(SUFFIX)
.F$(SUFFIX):
$(CPP)
$(SUFFIX).o:
$(FC) $(FFLAGS) $(OFLAG) $(INCS) -c $*$(SUFFIX)

# special rules
#-----------------------------------------------------------------------

# -tpp5|6|7 P, PII-PIII, PIV
# -xW use SIMD (does not pay of on PII, since fft3d uses double prec)
# all other options do no affect the code performance since -O1 is used

fft3dlib.o : fft3dlib.F
$(CPP)
$(F77) -FR -lowercase -O1 -tpp7 -xW -prefetch- -prev_div -unroll0 -e95 -vec_report3 -c $*$(SUFFIX)
fft3dfurth.o : fft3dfurth.F
$(CPP)
$(F77) -FR -lowercase -O1 -c $*$(SUFFIX)

radial.o : radial.F
$(CPP)
$(F77) -FR -lowercase -O1 -c $*$(SUFFIX)

symlib.o : symlib.F
$(CPP)
$(F77) -FR -lowercase -O1 -c $*$(SUFFIX)

symmetry.o : symmetry.F
$(CPP)
$(F77) -FR -lowercase -O1 -c $*$(SUFFIX)

dynbr.o : dynbr.F
$(CPP)
$(F77) -FR -lowercase -O1 -c $*$(SUFFIX)

us.o : us.F
$(CPP)
$(F77) -FR -lowercase -O1 -c $*$(SUFFIX)

wave.o : wave.F
$(CPP)
$(F77) -FR -lowercase -O0 -c $*$(SUFFIX)

LDApU.o : LDApU.F
$(CPP)
$(F77) -FR -lowercase -O2 -c $*$(SUFFIX)

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1楼2009-09-15 15:07:55

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wonderflyer

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★ ★
小木虫(金币+0.5):给个红包，谢谢回帖交流
qasd(金币+1,VIP+0):xiexie 11-2 19:36

在.bashrc中设置一下编译器的环境变量

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2楼2009-09-15 15:21:42

已阅回复此楼关注TA 给TA发消息送TA红花 TA的回帖

jglee646

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我在.bash_profile里面设置了
# MPI
export PATH=$PATH:/hptc_cluster/software/mpich-1.2.7/bin
并且source ~/.bash_profile
可还是不行啊

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3楼2009-09-15 15:32:38

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huangyc

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★
qasd(金币+1,VIP+0):xiexie 9-16 09:00

编译器的环境

source /opt/intel/fce/10.1.012/bin/ifortvars.sh
source /opt/intel/cce/10.1.012/bin/iccvars.sh

等

[ Last edited by huangyc on 2009-9-15 at 17:34 ]

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4楼2009-09-15 17:33:18

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jglee646

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我在~/.bash_profile里已经包含了下面内容
# Intel Compiler
. /opt/intel/fce/9.0/bin/ifortvars.sh
. /opt/intel/cce/9.0/bin/iccvars.sh
. /opt/intel/idbe/9.0/bin/idbvars.sh

# Intel MKL
. /opt/intel/mkl/9.0/tools/environment/mklvarsem64t.sh
export LD_LIBRARY_PATH=$LD_LIBRARY_PATH:/opt/intel/mkl/9.0/lib/em64t

# MPI
export PATH=$PATH:/hptc_cluster/software/mpich-1.2.7/bin

可还是不行啊，单机的VASP倒是可以编译通过，是mpi哪里出了问题呢？
我用which mpif90，结果是/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90，但是我把FC=/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90时，又出现新的错误

./preprocess base.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c base.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: base.f90: linker input file unused because linking not done
./preprocess mpi.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c mpi.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: mpi.f90: linker input file unused because linking not done
./preprocess smart_allocate.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c smart_allocate.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: smart_allocate.f90: linker input file unused because linking not done
./preprocess xml.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c xml.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: xml.f90: linker input file unused because linking not done
./preprocess constant.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c constant.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: constant.f90: linker input file unused because linking not done
./preprocess jacobi.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c jacobi.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: jacobi.f90: linker input file unused because linking not done
./preprocess main_mpi.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c main_mpi.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: main_mpi.f90: linker input file unused because linking not done
./preprocess scala.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c scala.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: scala.f90: linker input file unused because linking not done
./preprocess asa.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c asa.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: asa.f90: linker input file unused because linking not done
./preprocess lattice.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c lattice.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: lattice.f90: linker input file unused because linking not done
./preprocess poscar.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c poscar.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: poscar.f90: linker input file unused because linking not done
./preprocess ini.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c ini.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: ini.f90: linker input file unused because linking not done
./preprocess setex.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase  -O3 -xW -tpp7  -c setex.f90
gfortran: unrecognized option '-tpp7'
gfortran: language W not recognized
gfortran: language W not recognized
gfortran: -lowercase: linker input file unused because linking not done
gfortran: setex.f90: linker input file unused because linking not done
./preprocess radial.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DPROC_GROUP=8 -DRPROMU_DGEMV  -DRACCMU_DGEMV
/hptc_cluster/intel_linpack/intel_mpi/bin64/mpif90 -FR -lowercase -O1 -c radial.f90
In file radial.f90:51

USE prec
         1
Fatal Error: File 'prec.mod' opened at (1) is not a GFORTRAN module file
make: *** [radial.o] Error 1

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5楼2009-09-16 09:18:38

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quantumfang

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看出错信息，说得很明白：

No Fortran 90 compiler specified when mpif90 was created,
or configuration file does not specify a compiler.

你安装mpich的时候没有指定f90编译器

必须 ./configure -fc=ifort -cc=icc如此或者类似

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6楼2009-09-16 10:52:55

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