24小时热门版块排行榜

返回列表

当前主题已经存档。

当前只显示满足指定条件的回帖，点击这里查看本话题的所有回帖

kgdu

金虫 (正式写手)

应助: 1 (幼儿园)
金币: 475.4
红花: 8
帖子: 396
在线: 295.8小时
虫号: 893805
注册: 2009-11-04
性别: GG
专业: 凝聚态物性 II ：电子结构

[交流] 【求助】siesta3.0安装问题

　我是siesta新手，仿照写了个arch.make，copy到Src中make但出现以下错误：
make：***no target  stop
各位能不能帮我解决一下，我弄了好久了，先谢谢了。数学库应该是没有问题的。

#
# 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=-O2 -g
FPPFLAGS=
LDFLAGS=

ARFLAGS_EXTRA=

FCFLAGS_fixed_f=
FCFLAGS_free_f90=
FPPFLAGS_fixed_F=
FPPFLAGS_free_F90=

MATHLIB=/usr/local/math
BLAS_LIBS=$(MATHLIB)/BLAS/blas_LINUX.a
LAPACK_LIBS=$(MATHLIB)/lapack-3.2.1/lapack_LINUX.a
BLACS_LIBS=$(MATHLIB)/BLACS/LIB/blacsCinit_MPI-LINUX-0.a $(MATHLIB)/BLACS/LIB/blacsF77init_MPI-LINUX-0.a $(MATHLIB)/BLACS/LIB/blacs_MPI-LINUX-0.a
SCALAPACK_LIBS=$(MATHLIB)/scalapack-1.8.0/LIB/bscalapack.a

COMP_LIBS=dc_lapack.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=libmpi_f90.a
MPI_INCLUDE=/usr/local/mpich2-1.2/src/include
DEFS_MPI=-DMPI

DEFS= $(DEFS_CDF) $(DEFS_MPI)

#Dependency rules are created by autoconf according to whether
#discrete preprocessing is necessary or not.
.F.o:
$(FC) -c $(FFLAGS) $(DEFS)  $<
.F90.o:
$(FC) -c $(FFLAGS) $(DEFS)  $<
.f.o:
$(FC) -c $(FFLAGS)  $<
.f90.o:
$(FC) -c $(FFLAGS)  $<

回复此楼