[Q-e-developers] make.sys for the new machine: IDRIS - ADA

Lorenzo Paulatto lorenzo.paulatto at impmc.upmc.fr
Tue Dec 11 20:45:24 CET 2012


Yes, I agree with you, I did add the instruction to run a proper configure
in this case, although the result is not exactly the same it is
functionally equivalent.

However there is a case when this is impossible: if the compiler is more
than one word (i.e. "mpfort -compiler ifort") there is no way (known to me)
to have configure understand that. To be clear: adding the options in
FFLAGS does not help. The only solution I have is to write a small wrapper
script, but it's not 100% satisfactory.

cheers

On 11 December 2012 19:36, Paolo Giannozzi <giannozz at democritos.it> wrote:

>
> On Dec 11, 2012, at 18:59 , Emine Kucukbenli wrote:
>
> > Just wanted to let you know that we have a working make.sys file for
> > the new (in service since yesterday) "Ada" machine of French computing
> > center IDRIS, thanks to Lorenzo Paulatto from IMPMC !
> > You can find more info under install/README.IBM-INTEL.IDRIS_ada
> >
> > If you have similar hand-made make.sys :) files for other clusters,
> > please dont hesitate to share them with the rest of the community.
>
> thank you EMine and Lorenzo. If I may add a comment:
> in my opinion it is preferrable to specify the way "./configure" should
> be run, rather than (or in addition to) providing a "make.sys" file.
> The former is less likely to change with new releases. Moreover
> "./configure" should be run anyway, since it initialises "c_defs.h"
> and "fft_defs.h" as well
>
> Paolo
> ---
> Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
>
>
>
>
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>



-- 
Dr. Lorenzo Paulatto
IdR @ IMPMC -- CNRS & Université Paris 6
phone: +33 (0)1 44275 084 / skype: paulatz
www:   http://www-int.impmc.upmc.fr/~paulatto/
mail:  23-24/4é16 Boîte courrier 115, 4 place Jussieu 75252 Paris Cédex 05
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