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[½»Á÷] siesta3.1²¢ÐÐ ÒÑÓÐ3È˲ÎÓë

ÎÒÊǸöÐÂÊÖ£¬ÊÔ×űàÒëÁËа汾3.1£¬ÎÒûÓÐÔÚ×ܵķþÎñÆ÷ÉϱàÒ룬ֻÊÇÔÚÎÒ×Ô¼ºµÄ¶Ë¿Ú±àÒëÁËһϣ¬configureÖ®ºó¾Í×Ô¶¯³öÀ´Ò»¸öarch.makeÎļþ£¬ÆäÖÐÎÒÖ»ÐÞ¸ÄFC=mpif90ÕâÒ»¾ä£¨Õû¸öarch.make¼û×îºó£©£¬µ«ÊÇÔÚÔËÐÐmpirunµÄʱºò£¬³öÏÖÈçÏ´íÎó£º
No species found!!!
ERROR STOP from Node:    0
abort: Fortran Abort Called
No species found!!!
ERROR STOP from Node:    0
abort: Fortran Abort Called
No species found!!!
ERROR STOP from Node:    0
abort: Fortran Abort Called
--------------------------------------------------------------------------
mpirun noticed that the job aborted, but has no info as to the process
that caused that situation.
--------------------------------------------------------------------------
µ«ÊÇÎÒ¿´ÁË¿´³ÌÐò»¹ÊÇÔÚÔËÐУ¬ÔÚ.outÎļþµÄ¿ªÊ¼Ð´×ÅÕâÑùµÄÄÚÈÝ£¬ÎÒÓÃÁËmpirunÔõô»¹ÊÇserial versionÄØ£¿
Siesta Version:                                        siesta-3.1
Architecture  : x86_64-unknown-linux-gnu--unknown
Compiler flags: mpif90 -g -O2
SERIAL version
Siesta Version:                                        siesta-3.1
Architecture  : x86_64-unknown-linux-gnu--unknown
Compiler flags: mpif90 -g -O2
SERIAL version

* Running in serial mode
>> Start of run:  23-SEP-2011  10:45:13

arch.makeÈçÏ£º
#
# This file is part of the SIESTA package.
#
# Copyright (c) Fundacion General Universidad Autonoma de Madrid:
# E.Artacho, J.Gale, A.Garcia, J.Junquera, P.Ordejon, D.Sanchez-Portal
# and J.M.Soler, 1996- .
#
# Use of this software constitutes agreement with the full conditions
# given in the SIESTA license, as signed by all legitimate users.
#
.SUFFIXES:
.SUFFIXES: .f .F .o .a .f90 .F90

SIESTA_ARCH=x86_64-unknown-linux-gnu--unknown

FPP=
FPP_OUTPUT=
FC=mpif90
RANLIB=ranlib

SYS=nag

SP_KIND=4
DP_KIND=8
KINDS=$(SP_KIND) $(DP_KIND)

FFLAGS=-g -O2
FPPFLAGS= -DFC_HAVE_FLUSH -DFC_HAVE_ABORT
LDFLAGS=

ARFLAGS_EXTRA=

FCFLAGS_fixed_f=
FCFLAGS_free_f90=
FPPFLAGS_fixed_F=
FPPFLAGS_free_F90=

BLAS_LIBS=libblas.a
LAPACK_LIBS=dc_lapack.a liblapack.a
BLACS_LIBS=
SCALAPACK_LIBS=

COMP_LIBS=dc_lapack.a liblapack.a libblas.a

NETCDF_LIBS=
NETCDF_INTERFACE=

LIBS=$(SCALAPACK_LIBS) $(BLACS_LIBS) $(LAPACK_LIBS) $(BLAS_LIBS) $(NETCDF_LIBS)

#SIESTA needs an F90 interface to MPI
#This will give you SIESTA's own implementation
#If your compiler vendor offers an alternative, you may change
#to it here.
MPI_INTERFACE=
MPI_INCLUDE=

#Dependency rules are created by autoconf according to whether
#discrete preprocessing is necessary or not.
.F.o:
        $(FC) -c $(FFLAGS) $(INCFLAGS) $(FPPFLAGS) $(FPPFLAGS_fixed_F)  $<
.F90.o:
        $(FC) -c $(FFLAGS) $(INCFLAGS) $(FPPFLAGS) $(FPPFLAGS_free_F90) $<
.f.o:
        $(FC) -c $(FFLAGS) $(INCFLAGS) $(FCFLAGS_fixed_f)  $<
.f90.o:
        $(FC) -c $(FFLAGS) $(INCFLAGS) $(FCFLAGS_free_f90)  $<
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mika

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ÒýÓûØÌû:
2Â¥: Originally posted by identation at 2011-09-23 11:25:50:
http://muchong.com/bbs/viewthread.php?tid=2420318&fpage=1
http://muchong.com/bbs/viewthread.php?tid=1930406&fpage=1
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5Â¥2011-09-23 17:06:03
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identation

½ð³æ (ÖøÃûдÊÖ)

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Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
gzqdyouxia(½ð±Ò+2): ллÌáʾ 2011-09-23 12:04:28
2Â¥2011-09-23 11:25:50
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

souledge

ר¼Ò¹ËÎÊ (ÖøÃûдÊÖ)

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Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
zzy870720z(½ð±Ò+1): ллÌáʾ 2011-09-23 17:03:15
¿ÉÒÔÔÚconfigureʱ¼Ó¸ö--enable-mpi£¬ÕâÑù¹ØÓÚMPIµÄ¿âʲôµÄ¶¼×Ô¶¯¼ÓÔÚarch.makeÖÐÁË¡«
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4Â¥2011-09-23 16:40:52
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mika

½ð³æ (ÕýʽдÊÖ)

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ÒýÓûØÌû:
4Â¥: Originally posted by souledge at 2011-09-23 16:40:52:
¿ÉÒÔÔÚconfigureʱ¼Ó¸ö--enable-mpi£¬ÕâÑù¹ØÓÚMPIµÄ¿âʲôµÄ¶¼×Ô¶¯¼ÓÔÚarch.makeÖÐÁË¡«

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