24小时热门版块排行榜    

查看: 988  |  回复: 2
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

lei0819

金虫 (正式写手)

xcpu


[交流] [求助]linux 版本Abinit 安装问题 已有2人参与

是在 http://www.abinit.org/downloads/source-packages/abinit-1
上面下载的Abinit 软件,三个版本都下载了,有条件装的就是两个linux版本的,但是
只能 “Get ABINIT for All platforms (42MB)”的能装,但是装到后面出现下面的错误提示,不解。另外一个“Get ABINIT for Linux (83MB) ”版本解压后找不到“configure”.
  
请问这该怎么处理呢?
我的linux : CentOs

Summary of important options:

  * MPI    enabled: no
  * MPI-IO enabled: no
  * GPU    enabled: no (none)

  * TRIO   flavor = netcdf-fallback+etsf_io-fallback
  * TIMER  flavor = abinit (libs: ignored)
  * LINALG flavor = netlib-fallback (libs: auto-detected)
  * FFT    flavor = none (libs: ignored)
  * MATH   flavor = none (libs: ignored)
  * DFT    flavor = libxc-fallback+atompaw-fallback+bigdft-fallback+wannier90-fallback

Configuration complete.
You may now type "make" to build ABINIT.
(or, on a SMP machine, "make mj4", or "make multi multi_nprocs="

[xcpu@localhost abinit-6.6.3]$ make
make  all-recursive
make[1]: Entering directory `/home/xcpu/abinit-6.6.3'
Making all in plugins
make[2]: Entering directory `/home/xcpu/abinit-6.6.3/plugins'
Making all in linalg
make[3]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make -f ../../plugins/linalg/linalg.mk
make[4]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
mkdir lapack-abinit_6.0
cd lapack-abinit_6.0; \
          gzip -cd /home/xcpu/.abinit/tarballs/lapack-abinit_6.0.tar.gz | tar xf -
touch uncompress-stamp
lapack-abinit_6.0 has been uncompressed.
touch configure-stamp
lapack-abinit_6.0 has been configured.
cd lapack-abinit_6.0/blas && make \
          FC="gfortran" \
          FCFLAGS="-g   -O2 -mtune=native -march=native -mfpmath=sse -ffixed-form" \
          AR="ar" \
          ARFLAGS="rc" \
          RANLIB="ranlib"
make[5]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/linalg/lapack-abinit_6.0/blas'
gfortran -g   -O2 -mtune=native -march=native -mfpmath=sse -ffixed-form -c caxpy.f
caxpy.f:0: 错误:-march= 所带参数(native)不正确
caxpy.f:0: 错误:-mtune= 所带参数(native)不正确
make[5]: *** [caxpy.o] 错误 1
make[5]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/linalg/lapack-abinit_6.0/blas'
make[4]: *** [build-stamp] 错误 2
make[4]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make[3]: *** [package-ready] 错误 2
make[3]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make[2]: *** [all-recursive] 错误 1
make[2]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins'
make[1]: *** [all-recursive] 错误 1
make[1]: Leaving directory `/home/xcpu/abinit-6.6.3'
make: *** [all] 错误 2
[xcpu@localhost abinit-6.6.3]$ make
make  all-recursive
make[1]: Entering directory `/home/xcpu/abinit-6.6.3'
Making all in plugins
make[2]: Entering directory `/home/xcpu/abinit-6.6.3/plugins'
Making all in linalg
make[3]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make -f ../../plugins/linalg/linalg.mk
make[4]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
lapack-abinit_6.0 has been uncompressed.
touch configure-stamp
lapack-abinit_6.0 has been configured.
cd lapack-abinit_6.0/blas && make \
          FC="gfortran" \
          FCFLAGS="-g   -O2 -mtune=native -march=native -mfpmath=sse -ffixed-form" \
          AR="ar" \
          ARFLAGS="rc" \
          RANLIB="ranlib"
make[5]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/linalg/lapack-abinit_6.0/blas'
gfortran -g   -O2 -mtune=native -march=native -mfpmath=sse -ffixed-form -c caxpy.f
caxpy.f:0: 错误:-march= 所带参数(native)不正确
caxpy.f:0: 错误:-mtune= 所带参数(native)不正确
make[5]: *** [caxpy.o] 错误 1
make[5]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/linalg/lapack-abinit_6.0/blas'
make[4]: *** [build-stamp] 错误 2
make[4]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make[3]: *** [package-ready] 错误 2
make[3]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make[2]: *** [all-recursive] 错误 1
make[2]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins'
make[1]: *** [all-recursive] 错误 1
make[1]: Leaving directory `/home/xcpu/abinit-6.6.3'
make: *** [all] 错误 2
[xcpu@localhost abinit-6.6.3]$ make
make  all-recursive
make[1]: Entering directory `/home/xcpu/abinit-6.6.3'
Making all in plugins
make[2]: Entering directory `/home/xcpu/abinit-6.6.3/plugins'
Making all in linalg
make[3]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make -f ../../plugins/linalg/linalg.mk
make[4]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
lapack-abinit_6.0 has been uncompressed.
touch configure-stamp
lapack-abinit_6.0 has been configured.
cd lapack-abinit_6.0/blas && make \
          FC="gfortran" \
          FCFLAGS="-g   -O2 -mtune=native -march=native -mfpmath=sse -ffixed-form" \
          AR="ar" \
          ARFLAGS="rc" \
          RANLIB="ranlib"
make[5]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/linalg/lapack-abinit_6.0/blas'
gfortran -g   -O2 -mtune=native -march=native -mfpmath=sse -ffixed-form -c caxpy.f
caxpy.f:0: 错误:-march= 所带参数(native)不正确
caxpy.f:0: 错误:-mtune= 所带参数(native)不正确
make[5]: *** [caxpy.o] 错误 1
make[5]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/linalg/lapack-abinit_6.0/blas'
make[4]: *** [build-stamp] 错误 2
make[4]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make[3]: *** [package-ready] 错误 2
make[3]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make[2]: *** [all-recursive] 错误 1
make[2]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins'
make[1]: *** [all-recursive] 错误 1
make[1]: Leaving directory `/home/xcpu/abinit-6.6.3'
make: *** [all] 错误 2
[xcpu@localhost abinit-6.6.3]$ make install
Making install in plugins
make[1]: Entering directory `/home/xcpu/abinit-6.6.3/plugins'
Making install in linalg
make[2]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make[3]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make[3]: Nothing to be done for `install-exec-am'.
make[3]: Nothing to be done for `install-data-am'.
make[3]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
make[2]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/linalg'
Making install in netcdf
make[2]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/netcdf'
make[3]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/netcdf'
make[3]: Nothing to be done for `install-exec-am'.
make[3]: Nothing to be done for `install-data-am'.
make[3]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/netcdf'
make[2]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/netcdf'
Making install in etsf_io
make[2]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/etsf_io'
make[3]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/etsf_io'
make[3]: Nothing to be done for `install-exec-am'.
make[3]: Nothing to be done for `install-data-am'.
make[3]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/etsf_io'
make[2]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/etsf_io'
Making install in libxc
make[2]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/libxc'
make[3]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/libxc'
make[3]: Nothing to be done for `install-exec-am'.
make[3]: Nothing to be done for `install-data-am'.
make[3]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/libxc'
make[2]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/libxc'
Making install in atompaw
make[2]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/atompaw'
make[3]: Entering directory `/home/xcpu/abinit-6.6.3/plugins/atompaw'
test -z "/usr/local/bin" || /bin/mkdir -p "/usr/local/bin"
/usr/bin/install -c atompaw graphatom "/usr/local/bin"
/usr/bin/install: 无法 stat “atompaw”: 没有那个文件或目录
/usr/bin/install: 无法 stat “graphatom”: 没有那个文件或目录
make[3]: *** [install-exec-local] 错误 1
make[3]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/atompaw'
make[2]: *** [install-am] 错误 2
make[2]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins/atompaw'
make[1]: *** [install-recursive] 错误 1
make[1]: Leaving directory `/home/xcpu/abinit-6.6.3/plugins'
make: *** [install-recursive] 错误 1
[xcpu@localhost abinit-6.6.3]$
回复此楼

» 猜你喜欢

» 本主题相关价值贴推荐,对您同样有帮助:

已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖

souledge

专家顾问 (著名写手)

★ ★ ★
小木虫(金币+0.5):给个红包,谢谢回帖
zzy870720z(金币+2): 谢谢指教 2011-07-06 14:18:17
引用回帖:
Originally posted by jinbiandou at 2011-05-19 12:09:31:
Get ABINIT for Linux (83MB) ”版那个已经编辑好,你按照readme可以进行计算,但是我的电脑上不能并行

并行的话,在编译时加上--enable-mpi,并且为了编译通过,最好加上--with-mpi-level=。顺便,指定fortran编译器为MPI的Fortran编译器会提高编译成功率~
思想重于技巧,内涵重于表象
3楼2011-07-05 20:46:26
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖
查看全部 3 个回答

jinbiandou

铁杆木虫 (正式写手)

★ ★
小木虫(金币+0.5):给个红包,谢谢回帖
zzy870720z(金币+1): 鼓励交流 2011-07-06 14:18:09
Get ABINIT for Linux (83MB) ”版那个已经编辑好,你按照readme可以进行计算,但是我的电脑上不能并行
2楼2011-05-19 12:09:31
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖
普通表情 高级回复 (可上传附件)
最具人气热帖推荐 [查看全部] 作者 回/看 最后发表
[考研] 307求调剂 +3 wyyyqx 2026-03-17 3/150 2026-03-21 03:20 by JourneyLucky
[考研] 303求调剂 +5 睿08 2026-03-17 7/350 2026-03-21 03:11 by JourneyLucky
[考研] 297求调剂 +9 戏精丹丹丹 2026-03-17 9/450 2026-03-21 01:49 by JourneyLucky
[考研] 324求调剂 +5 lucky呀呀呀鸭 2026-03-20 5/250 2026-03-20 22:30 by 促天成
[考研] 一志愿苏州大学材料求调剂,总分315(英一) +5 sbdksD 2026-03-19 5/250 2026-03-20 22:10 by luoyongfeng
[考研] 295材料求调剂,一志愿武汉理工085601专硕 +5 Charlieyq 2026-03-19 5/250 2026-03-20 20:35 by JourneyLucky
[考研] 材料与化工专硕调剂 +7 heming3743 2026-03-16 7/350 2026-03-20 19:31 by zhukairuo
[考研] 一志愿南理工085701环境302求调剂院校 +3 葵梓卫队 2026-03-20 3/150 2026-03-20 19:28 by zhukairuo
[考研] 085410人工智能专硕317求调剂(0854都可以) +4 xbxudjdn 2026-03-18 4/200 2026-03-20 09:07 by 不168
[考研] 材料学硕318求调剂 +5 February_Feb 2026-03-19 5/250 2026-03-19 23:51 by 23Postgrad
[考研] 一志愿天津大学化学工艺专业(081702)315分求调剂 +11 yangfz 2026-03-17 11/550 2026-03-19 15:06 by houyaoxu
[考研] 材料与化工求调剂 +7 为学666 2026-03-16 7/350 2026-03-19 14:48 by 尽舜尧1
[考研] 268求调剂 +6 简单点0 2026-03-17 6/300 2026-03-18 09:04 by 无际的草原
[考研] 268求调剂 +8 一定有学上- 2026-03-14 9/450 2026-03-17 17:47 by laoshidan
[考研] [导师推荐]西南科技大学国防/材料导师推荐 +3 尖角小荷 2026-03-16 6/300 2026-03-16 23:21 by 尖角小荷
[考研] 333求调剂 +3 文思客 2026-03-16 7/350 2026-03-16 18:21 by 文思客
[考研] 一志愿211 0703方向310分求调剂 +3 努力奋斗112 2026-03-15 3/150 2026-03-16 16:44 by houyaoxu
[考研] 070300化学学硕求调剂 +6 太想进步了0608 2026-03-16 6/300 2026-03-16 16:13 by kykm678
[考研] 277材料科学与工程080500求调剂 +3 自由煎饼果子 2026-03-16 3/150 2026-03-16 14:10 by 运气yunqi
[考研] 复试调剂 +3 呼呼?~+123456 2026-03-14 3/150 2026-03-14 16:53 by WTUChen
信息提示
请填处理意见