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gjh123

½ð³æ (ÕýʽдÊÖ)

[ÇóÖú] vasp ±àÒë³ö´í £¨ÇóÖú£©

ʹÓÃpgi ÔÚ·þÎñÆ÷Éϲ¢ÐбàÒëvasp 5.2£¬ÔÚ±àÒëvasp.5.libʱ³ö´í£º

[root@cluster vasp.5.lib]# make
mpif90 -Mx,119,0x200000  -O1 -tp k8-64 -i8 -Mfree  -c preclib.f
mpif90 -Mx,119,0x200000  -O1 -tp k8-64 -i8 -Mfree  -c diolib.f
mpif90 -Mx,119,0x200000  -O1 -tp k8-64 -i8 -Mfree  -c dlexlib.f
mpif90 -Mx,119,0x200000  -O1 -tp k8-64 -i8 -Mfree  -c drdatab.f
rm libdmy.a
rm: cannot remove `libdmy.a': No such file or directory
make: [libdmy.a] Error 1 (ignored)
ar vq libdmy.a preclib.o timing_.o derrf_.o dclock_.o  diolib.o dlexlib.o drdatab.o
ar: creating libdmy.a
ar: preclib.o: No such file or directory
make: *** [libdmy.a] Error 1

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gjh123

½ð³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
2Â¥: Originally posted by mazuju028 at 2011-08-24 17:49:48:
Òª¿´Ò»ÏÂmakefile²ÅÖªµÀÎÊÌâ°¡¡£
Ò»°ã°ÉFCÉèÖÃÕýÈ·£¬±àÒëÓ¦¸ÃûÓÐÎÊÌâµÄ¡£

Õâ¸öÊÇÎÒµÄmakefile, Âé·³°æÖ÷°ïÎÒ¿´¿´ÄĸöµØ·½³ö´íÁ˰ɣ¿

Last login: Wed Aug 24 21:05:52 2011
Rocks 5.3 (Rolled Tacos)
Profile built 20:55 26-May-2011
Kickstarted 05:21 27-May-2011
[root@cluster ~]# cd /sourcecode/vasp5.2/vasp.5.lib
[root@cluster vasp.5.lib]# vi makefile
.SUFFIXES: .inc .f .F
#-----------------------------------------------------------------------
# Makefile for Portland Group F90/HPF compiler
# the makefile was tested only under Linux on Intel platforms
# however it might work on other platforms as well
#
# this release of vasp.4.lib contains lapack v2.0
# this can be compiled with pgf90 compiler if the option -O1 is used
#
# Mind: one user reported that he had to copy preclib.F diolib.F
#  dlexlib.F and drdatab.F to the directory vasp.4.4, compile the files
#  there and link them directly  into vasp
#  for no obvious reason these files could not be linked from the library
#
#-----------------------------------------------------------------------

# C-preprocessor
CPP     = mpicc -E -P -C $*.F >$*.f
FC=mpif90 -Mx,119,0x200000

CFLAGS = -O
FFLAGS = -O1 -tp k8-64 -i8
FREE   = -Mfree

DOBJ =  preclib.o timing_.o derrf_.o dclock_.o  diolib.o dlexlib.o drdatab.o


#-----------------------------------------------------------------------
# general rules
#-----------------------------------------------------------------------

libdmy.a: $(DOBJ) lapack_double.o linpack_double.o lapack_atlas.o
        -rm libdmy.a
        ar vq libdmy.a $(DOBJ)

# files which do not require autodouble
lapack_double.o: lapack_double.f
        $(FC) $(FFLAGS) $(NOFREE) -c lapack_double.f
lapack_single.o: lapack_single.f
        $(FC) $(FFLAGS) $(NOFREE) -c lapack_single.f
lapack_atlas.o: lapack_atlas.f
        $(FC) $(FFLAGS) $(NOFREE) -c lapack_atlas.f
linpack_double.o: linpack_double.f
        $(FC) $(FFLAGS) $(NOFREE) -c linpack_double.f
linpack_single.o: linpack_single.f
        $(FC) $(FFLAGS) $(NOFREE) -c linpack_single.f

.c.o:
        $(CC) $(CFLAGS) -c $*.c
.F.o:
        $(CPP)
        $(FC) $(FFLAGS) $(FREE) $(INCS) -c $*.f
.F.f:
        $(CPP)
.f.o:
        $(FC) $(FFLAGS) $(FREE) $(INCS) -c $*.f
3Â¥2011-08-24 21:08:04
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²é¿´È«²¿ 10 ¸ö»Ø´ð

mazuju028

ľ³æ (ÕýʽдÊÖ)

¡¾´ð°¸¡¿Ó¦Öú»ØÌû

¡ï
gjh123(½ð±Ò+10): 2011-08-24 21:09:09
youzhizhe(½ð±Ò+1): лл½»Á÷¡£ 2011-08-25 23:37:07
Òª¿´Ò»ÏÂmakefile²ÅÖªµÀÎÊÌâ°¡¡£
Ò»°ã°ÉFCÉèÖÃÕýÈ·£¬±àÒëÓ¦¸ÃûÓÐÎÊÌâµÄ¡£
ÈñÆø²ØÓÚÐØ£¬ºÍÆø¸¡ÓÚÁ³£¬²ÅÆø¼ûÓÚÊ£¬ÒåÆøÊ©ÓëÈË
2Â¥2011-08-24 17:49:48
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

mazuju028

ľ³æ (ÕýʽдÊÖ)

¡¾´ð°¸¡¿Ó¦Öú»ØÌû

¡ï
gjh123(½ð±Ò+10): 2011-08-25 10:29:28
youzhizhe(½ð±Ò+1): лл½»Á÷¡£ 2011-08-25 23:37:16
ÒýÓûØÌû:
3Â¥: Originally posted by gjh123 at 2011-08-24 21:08:04:
Õâ¸öÊÇÎÒµÄmakefile, Âé·³°æÖ÷°ïÎÒ¿´¿´ÄĸöµØ·½³ö´íÁ˰ɣ¿

Last login: Wed Aug 24 21:05:52 2011
Rocks 5.3 (Rolled Tacos)
Profile built 20:55 26-May-2011
Kickstarted 05:21 27-May-2011
[root@clus ...

ÄãµÄmpif90ÄÜÓÃÂð£¿
ÈñÆø²ØÓÚÐØ£¬ºÍÆø¸¡ÓÚÁ³£¬²ÅÆø¼ûÓÚÊ£¬ÒåÆøÊ©ÓëÈË
4Â¥2011-08-24 23:18:34
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

gjh123

½ð³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
4Â¥: Originally posted by mazuju028 at 2011-08-24 23:18:34:
ÄãµÄmpif90ÄÜÓÃÂð£¿

°æÖ÷ÄúºÃ£¬ÎҰѱàÒëÆ÷¸Ã³Éifort ºó£¬±àÒë³öÁËlibdmy.a. È»ºóÎÒÔÙÓÃopenmpi ±àÒëvasp ʱ£¬ÓÖ³öÏÖÁËÒ»¸öÎÊÌâ:
[root@cluster vasp.5.2]# make
./preprocess xml.f90 -DMPI  -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DCACHE_SIZE=16000 -DPGF90 -Davoidalloc -DNGZhalf -DMPI_BLOCK=8000    -DRPROMU_DGEMV  -DRACCMU_DGEMV
/opt/openmpi/bin/mpif90 -FR -lowercase   -O3  -c xml.f90
In file xml.f90:976
,str(
    1
Error: Syntax error in argument list at (1)
In file xml.f90:1029
,str(
    1
Error: Syntax error in argument list at (1)
make: *** [xml.o] Error 1

Õâ¸öÎÊÌâÔõô½â¾ö°¡£¿
5Â¥2011-08-25 10:35:55
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
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