Dear GBokas, See the attachment.
Then mkl link line setting used by me is obtain by intel's mkl_link_tool, which is a local version of the intel link advisor. I also use the suggested comipling directory by siesta group. i.e., the Obj directory. Regards hs.zhao 2014/1/12, George Bokas <[email protected]>: > Dear Hongyi Zhao, > > Can you please attach the arch.make file you are using? > Also you have to be sure that the arch.make is at the correct directory. > > Regards, > GBokas > > Sent from my iPad > >> On 12 Ιαν 2014, at 7:35, Hongyi Zhao <[email protected]> wrote: >> >> Dear Bartek Szyja, >> >> Perhaps I don't describe it so clearly. >> >> I mean in the arch.make, I use the following line: >> >> FFLAGS= -O2 -I$(MKLROOT)/include/intel64/lp64/ >> >> But, when I compiled it, the siesta give the following information: >> >> -I/opt/intel/composer_xe_2013_sp1.0.080/mkl/include/intel64/llp64/ >> >> You can see the the path is expanded to a wrong one: >> >> -I$(MKLROOT)/include/intel64/lp64/ >> >> should be expanded to >> >> -I/opt/intel/composer_xe_2013_sp1.0.080/mkl/include/intel64/lp64/ >> >> instead of >> >> -I/opt/intel/composer_xe_2013_sp1.0.080/mkl/include/intel64/llp64/ >> >> Regards >> hs.zhao >> >> >> 2014/1/11, Bartek Szyja <[email protected]>: >>>> On Sat, 2014-01-11 at 15:22 +0800, Hongyi Zhao wrote: >>>> Please note the following line appeared in the above message: >>>> >>>> ------------ >>>> -I/opt/intel/composer_xe_2013_sp1.0.080/mkl/include/intel64/llp64/ >>>> -------------- >>>> >>>> Though for my case, this will not do any harm due to the correct >>>> settings given by intel's mklvars.sh. But it's obviously that this is >>>> a >>>> bug of the siesta code when it pass the include line for compiling. >>> >>> Well, this is not so obvious to me. Can you please explain why you think >>> it is a bug? >>> >>> Cheers, >>> Bartek >> >> >> -- >> Hongyi Zhao <[email protected]> >> Xinjiang Technical Institute of Physics and Chemistry >> Chinese Academy of Sciences >> GnuPG DSA: 0xD108493 > -- Hongyi Zhao <[email protected]> Xinjiang Technical Institute of Physics and Chemistry Chinese Academy of Sciences GnuPG DSA: 0xD108493
arch.make
Description: Binary data
