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love5264

木虫 (正式写手)

[求助] siesta-3.1编译成功,但有几个问题求助

ifort12.1+openmpi-1.4.5+siesta-3.1
centos 6.2
问题一
arch.make文件里
FFLAGS=?(怎么设置?)
看到网上帖子有:
FFLAGS=-O2 -mp1 -pad -ip
FFLAGS=-O2 -i-static
FFLAGS=-g -O2
等
请教各位前辈,这后面值应该怎么写?或者在哪能找到相关信息?
问题二
库
BLAS_LIBS=
LAPACK_LIBS=
BLACS_LIBS=
SCALAPACK_LIBS=

请教各位前辈,都需要填哪些库?我看大家写的都不完全一样?哪些库是必须的,顺序应该怎样?
还有-lguide -pthread -openmp 这几个应该加在哪?

谢谢!

[ 来自科研家族 Solar Cells 之家 ]
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lemonare

新虫 (小有名气)

【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与,应助指数 +1
fzx2008: 金币+1, 谢谢回帖交流! 2012-04-25 16:00:53
love5264: 回帖置顶 2012-04-26 20:36:19
love5264: 金币+10, ★★★很有帮助, 感谢你的回复! 2012-04-26 20:36:59
love5264: 取消置顶 2012-05-02 16:27:03
这是我在网上找到的:
FFLAGS=-O3 -ipo -xHost -ip -prec-div -prec-sqrt -opt-prefetch -mkl=parallel
Do not use -g ( you cant debug, but if you havnt had use for it, then why
use it? )
Do not use -mp, it is a deprecated option and there are other flags that
should perform better. For instance  -prec-div -prec-sqrt.
-ipo will make the compile time a much longer process when linking in the
final step, i have seen little performance gain from this.
-xHost should be used if the machine you compile on is the same as the
excution nodes. Otherwise you should use -xSSE3 (E5000 has this).
The last -mkl=parallel enables the mkl library to use parallel execution on
some of the routines (notice that this option will not affect blacs as it is
already parallelised.). I have had better runs with it! But be aware that
you have to set the OMP_NUM_THREADS=x, otherwise it will use all available cores on the machine.
每一天都是一个成长的过程!
4楼2012-04-25 15:58:57
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love5264

木虫 (正式写手)

找到一个:
$ ifort -help opt
Optimization
------------

-O1       optimize for maximum speed, but disable some optimizations which
          increase code size for a small speed benefit
-O2       optimize for maximum speed (DEFAULT)
-O3       optimize for maximum speed and enable more aggressive optimizations
          that may not improve performance on some programs
-O        same as -O2
-Os       enable speed optimizations, but disable some optimizations which
          increase code size for small speed benefit
-O0       disable optimizations
-fast     enable -xHOST -O3 -ipo -no-prec-div -static
          options set by -fast cannot be overridden with the exception of
          -xHOST, list options separately to change behavior
-Ofast    enable -O3 -no-prec-div optimizations
-fno-alias
          assume no aliasing in program
-fno-fnalias
          assume no aliasing within functions, but assume aliasing across calls
-nolib-inline
          disable inline expansion of intrinsic functions
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2楼2012-04-14 22:53:27
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★
感谢参与,应助指数 +1
liliangfang: 金币-1, 违规存档, 非应助请勿选择应助回帖 2012-04-17 09:09:08
zzy870720z: 应助指数-1, 扣回应助指数,下次注意 2012-04-20 12:17:08
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3楼2012-04-17 08:56:04
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guohuazhong

至尊木虫 (职业作家)

★
WDD880227: 金币+1, 感谢交流提示 2012-04-27 08:53:10
FFLAGS=-O3 我的编译器,优化级别设成-O3会提示被0除的情况

» 本帖已获得的红花(最新10朵)

5楼2012-04-25 17:50:13
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