Re: [Pw_forum] [QE-GPU] qe version and gpu model

2017-09-20 Thread fabricio
Em 19-09-2017 17:09, Paolo Giannozzi escreveu: > Are there any plans by other compilers to support CUDA Fortran ... ? I see. Thanks Paolo. Filippo, would you please elaborate on the reasons to choose CUDA Fortran instead of, say, OpenACC? TIA, Fabri

Re: [Pw_forum] [QE-GPU] qe version and gpu model

2017-09-19 Thread fabricio
Em 19-09-2017 07:46, Paolo Giannozzi escreveu: > The page is 6 years old, but the link "download page" leads to a page > that is one month old and that contains a link to a git repository that > is 13 hours old: https://github.com/RSE-Cambridge/qe-gpu/ > > Paolo Is there a plan to (eventually)

[Pw_forum] qe-6.0 consistent errors when testing

2016-10-27 Thread Fabricio Cannini
--without-elpa ''' Here's the link to the errors. http://pastebin.com/z5B3GgJu In the words of Barry Burton, WHAT IS THIS? TIA, Fabricio ___ Pw_forum mailing list Pw_forum@pwscf.org

Re: [Pw_forum] errors testing espresso 5.4.0

2016-09-20 Thread Fabricio Cannini
Em 21-09-2016 02:39, Paolo Giannozzi escreveu: > > On Wed, Sep 21, 2016 at 7:20 AM, Fabricio Cannini <fcann...@gmail.com > <mailto:fcann...@gmail.com>> wrote: > > > However, I'm no longer able to compile Phonon with the version you > sent me, which is

Re: [Pw_forum] errors testing espresso 5.4.0

2016-09-20 Thread Fabricio Cannini
Em 21-09-2016 02:20, Fabricio Cannini escreveu: > Em 10-09-2016 04:17, Paolo Giannozzi escreveu: >> Tests are typically small. When run on many processors, they may give >> some funny errors. It was nothing to worry about, but I fixed it anyway >> in the developme

Re: [Pw_forum] errors testing espresso 5.4.0

2016-09-20 Thread Fabricio Cannini
fixes, or even better, a 5.4.1 release? TIA, Fabricio ___ Pw_forum mailing list Pw_forum@pwscf.org http://pwscf.org/mailman/listinfo/pw_forum

Re: [Pw_forum] errors testing espresso 5.4.0

2016-09-09 Thread Fabricio Cannini
Em 09-09-2016 03:15, Paolo Giannozzi escreveu: > It does not look like a true bug, because the out-of-bound array element > is not used when the array is zero-sized. How many processors did you > use to make your test, by the way? at least one processor has no G-vectors I can reliably trigger

Re: [Pw_forum] errors testing espresso 5.4.0

2016-09-08 Thread Fabricio Cannini
Em 06-09-2016 19:26, Filippo SPIGA escreveu: > On Sep 5, 2016, at 6:19 PM, Fabricio Cannini <fcann...@gmail.com> wrote: >> I can make some more tests if it helps, just tell me what to do. > > Grab this latest full snapshot of QE SVN repo I just generated > http://qe-forg

Re: [Pw_forum] errors testing espresso 5.4.0

2016-09-05 Thread Fabricio Cannini
Em 05-09-2016 14:11, Paolo Giannozzi escreveu: > ... and, I think, only the case in which the physical dimensions of FFT > arrays are larger than the FFT dimensions Hi Filippo and Paolo, I can make some more tests if it helps, just tell me what to do. [ ]'d

Re: [Pw_forum] errors testing espresso 5.4.0

2016-09-05 Thread Fabricio Cannini
Em 04-09-2016 10:08, Filippo SPIGA escreveu: > Dear Fabricio, Hello Filippo, > are you running these tests manually or via test-suite? I'm running the tests via test-suite. > Well, the error messages are quite clear so it is a matter of investigate if > these are repsoducible. We

[Pw_forum] errors testing espresso 5.4.0

2016-09-02 Thread Fabricio Cannini
Unknown Unknown Unknown --- All messages are similar so they may have a common cause, but I'm unable to tell why exactly. Any ideas? TIA, Fabricio ___ Pw_forum mailing list Pw_forum@pwscf.org http://pwscf.org/mailman/listinfo/pw_forum

Re: [Pw_forum] Version 5.4.0 of Quantum ESPRESSO is available for download

2016-04-28 Thread Fabricio Cannini
On 28-04-2016 10:00, Filippo SPIGA wrote: > Hello Fabricio, > > On Apr 25, 2016, at 10:46 PM, Fabricio Cannini <fcann...@gmail.com> wrote: >> I'm not sseing 'QE-GPU-5.4.0.tar.gz' on the qe-forge link, and no >> mention of it in 'Doc/release-notes'. Am I missing so

Re: [Pw_forum] Version 5.4.0 of Quantum ESPRESSO is available for download

2016-04-25 Thread Fabricio Cannini
On 25-04-2016 17:09, Filippo SPIGA wrote: > Dear everybody, > > I am pleased to announce you that version 5.4.0 of Quantum ESPRESSO (SVN > revision r12350) is now available for download. > > You can find all related packages published on the QE-FORGE website at this > link: >

[Pw_forum] SATA vs SAS

2014-08-07 Thread Fabricio Cannini
On 07-08-2014 09:48, Carlo Nervi wrote: > I completely agree with Axel, expecially speaking about a middle-range > machine (as mine, for example, a linux home-assembled server with a > careful look at the costs). I was under the same impression that SSDs have a shorter life span than HDDs, but

[Pw_forum] Problem with espresso and cuda 6.0

2014-07-12 Thread Fabricio Cannini
2014-07-12 10:36 GMT-03:00 Filippo Spiga : > Dear Fabricio, > Hi Filippo > On Jul 11, 2014, at 2:55 AM, Fabricio Cannini wrote: > > ./configure BLAS_LIBS=-lopenblas > > MANUAL_DFLAGS="-D__DISABLE_CUDA_ADDUSDENS -D__DISABLE_CUDA_VLOCPSI" > > --enable-cud

[Pw_forum] Problem with espresso and cuda 6.0

2014-07-10 Thread Fabricio Cannini
On 08-07-2014 06:42, Filippo Spiga wrote: > Dear Fabricio, > > On Jul 8, 2014, at 12:04 AM, Fabricio Cannini > wrote: >> I'm using 14.06 version of qe-gpu from here [ >> https://github.com/fspiga/QE-GPU/ ] . Strangely, it has no >> 'espresso-5.1' directory nor

[Pw_forum] Problem with espresso and cuda 6.0

2014-07-07 Thread Fabricio Cannini
in the "I" Is it a bug in the './configure' script ? TIA, Fabricio

[Pw_forum] Using Intel Fortran, C++ complier- parallel, serial versions - reg.,

2014-06-04 Thread Fabricio Cannini
Em 04-06-2014 13:42, Muthu V escreveu: > Dear users > usually i install QE by installing FFTW lib and Fortran complier. > everything goes fine with serial and parallel installation of QE. > > but i heard that using intel C++, fortran (ifort, icc ) compliers for > intel core(i am using intel i5

[Pw_forum] espresso-5.0.2 error when testing modules

2014-04-14 Thread Fabricio Cannini
Em 14-04-2014 13:51, ??? escreveu: Hi there. > 2.For PP/examples, still the same error: gamma_only case not implemented IIRC, this was fixed in 5.0.3 . I'm afraid i can't answer your other questions. > I don?t know its specific reasons. > > 3.For testfiles under PWCOND, there is one common

[Pw_forum] Compile QE v-4.3.2

2014-02-05 Thread Fabricio Cannini
Em 05-02-2014 21:16, Vo, Trinh (398C) escreveu: > Dear QE users, > > In compiling QE in order to know whether the external fftw library > included in Intel MKL (version 13) is used, instead of internal fftw > is used, I changed the name of the file "fftw.c" in the directory "clib" > into

[Pw_forum] Undefined reference to gfortran

2014-01-24 Thread Fabricio Cannini
Em 24-01-2014 15:02, Axel Kohlmeyer escreveu: > On Fri, Jan 24, 2014 at 11:57 AM, BENYAHIA NEZHA > wrote: >> Hello, >> I'am using quantum espresso in my searches, but i'am still a beginner in >> this domain. I have faced a problem in which it prevent me to compile my >> program, i have looked

[Pw_forum] Problem with QE 4.2.1 and AMD Opteron 6200 / 6300

2014-01-13 Thread Fabricio Cannini
running old versions of intel ifort ( 11.1 ), which could not possibly have good performance in a much newer machine. Once again, Thanks for your time. Fabricio

[Pw_forum] Strange benchmark results

2014-01-13 Thread Fabricio Cannini
Hi there I'm running some tests on the following machine : - 2x AMD Opteron 6380 ( 32 cores ) - 64GB RAM - Ubuntu 12.04 ( gfortran 4.6, fftw 3.3.1, openblas 0.2.8, openmpi 1.4.3 ) Using these benchmarks : - Medium size DEISA benchmark :

[Pw_forum] Problem with QE 4.2.1 and AMD Opteron 6200 / 6300

2013-12-17 Thread Fabricio Cannini
Em 12-12-2013 08:20, Ivan Girotto escreveu: > Dear Fabricio, > > I reckon there is some inconsistency in the results you are obtaining. > The AMD 6380 is a 16-core model. I'm wondering how do you map the > process affinity while running on 8 cores. > Without controlling such mapp

[Pw_forum] Problem with QE 4.2.1 and AMD Opteron 6200 / 6300

2013-12-17 Thread Fabricio Cannini
Em 12-12-2013 08:20, Ivan Girotto escreveu: > Dear Fabricio, > > I reckon there is some inconsistency in the results you are obtaining. > The AMD 6380 is a 16-core model. I'm wondering how do you map the > process affinity while running on 8 cores. > Without controlling such mapp

[Pw_forum] Problem with QE 4.2.1 and AMD Opteron 6200 / 6300

2013-12-11 Thread Fabricio Cannini
Em 11-12-2013 15:51, Paolo Giannozzi escreveu: > On Tue, 2013-12-10 at 19:49 -0200, Fabricio Cannini wrote: >> Em 10-12-2013 18:34, Paolo Giannozzi escreveu: >>> First of all you should verify if multi-threading libraries >>> are conflicting with MPI paralleliza

[Pw_forum] Problem with QE 4.2.1 and AMD Opteron 6200 / 6300

2013-12-10 Thread Fabricio Cannini
Em 10-12-2013 18:34, Paolo Giannozzi escreveu: > First of all you should verify if multi-threading libraries > are conflicting with MPI parallelization. Yes, i did look into it already. I can send you the 'make.sys' files of all compilations if it helps . TIA, Fabricio

[Pw_forum] Problem with QE 4.2.1 and AMD Opteron 6200 / 6300

2013-12-10 Thread Fabricio Cannini
ist . ;) Should I re-run the tests with the newest QE ? TIA, Fabricio

[Pw_forum] Problem with QE 4.2.1 and AMD Opteron 6200 / 6300

2013-12-09 Thread Fabricio Cannini
sys' files to another message or paste it somewhere ? TIA Fabricio