PWSCF Forum
Subject: Re: [Pw_forum] mpi error using pw.x
On May 16, 2016, at 11:12 PM, Chong Wang <ch-w...@outlook.com> wrote:
> 1. With intel parallel studio 2016 update3, Errors in my original post
> persists.
We had little compiler issue with Intel 16 in the past, I would not be
On May 16, 2016, at 11:12 PM, Chong Wang wrote:
> 1. With intel parallel studio 2016 update3, Errors in my original post
> persists.
We had little compiler issue with Intel 16 in the past, I would not be
surprised is somwthing else is broken. Which exact version of Intel
nday, May 16, 2016 9:43 PM
To: PWSCF Forum
Subject: Re: [Pw_forum] mpi error using pw.x
Hi Chong Wang,
Perhaps it would be better to run ./configure with,
./configure CC=icc CXX=icpc F90=ifort F77=ifort MPIF90=mpiifort
--with-scalapack=intel
so that QE knows which compiler to use, verified with QE v5
May 16, 2016 3:10 AM
*To:* PWSCF Forum
*Subject:* Re: [Pw_forum] mpi error using pw.x
Your make.sys shows clear signs of mixup between ifort and
gfortran. Please verify that mpif90 calls ifort and not gfortran
(or vice versa). Configure issues a warning if this happens.
I have success
<pw_forum-boun...@pwscf.org> on behalf
> of Paolo Giannozzi <p.gianno...@gmail.com>
> *Sent:* Monday, May 16, 2016 3:10 AM
> *To:* PWSCF Forum
> *Subject:* Re: [Pw_forum] mpi error using pw.x
>
> Your make.sys shows clear signs of mixup between ifort and gfortran.
&g
;p.gianno...@gmail.com>
Sent: Monday, May 16, 2016 3:10 AM
To: PWSCF Forum
Subject: Re: [Pw_forum] mpi error using pw.x
Your make.sys shows clear signs of mixup between ifort and gfortran. Please
verify that mpif90 calls ifort and not gfortran (or vice versa). Configure
issues a warning if this
ar command and flags - for most architectures: AR = ar, ARFLAGS = ruv
>
>
> AR = ar
>
> ARFLAGS = ruv
>
>
> # ranlib command. If ranlib is not needed (it isn't in most cases) use
>
> # RANLIB = echo
>
>
> RANLIB = ranlib
>
>
used
PREFIX = /usr/local
Cheers!
Chong Wang
From: pw_forum-boun...@pwscf.org <pw_forum-boun...@pwscf.org> on behalf of
Paolo Giannozzi <p.gianno...@gmail.com>
Sent: Sunday, May 15, 2016 8:28:26 PM
To: PWSCF Forum
Subject: Re: [Pw_forum] mpi error using p
ror stack:
> PMPI_Cart_sub(242)...: MPI_Cart_sub(comm=0xc400fcf3,
> remain_dims=0x7ffd10080408, comm_new=0x7ffd10080360) failed
> PMPI_Cart_sub(178).......:
>
> Cheers!
>
> Chong
> --
> *From:* pw_forum-boun...@pwscf.org
To: PWSCF Forum
Subject: Re: [Pw_forum] mpi error using pw.x
Please tell us what is wrong and we will fix it.
Seriously: nobody can answer your question unless you specify, as a strict
minimum, input data, number of processors and type of parallelization that
trigger the error, and where the erro
Please tell us what is wrong and we will fix it.
Seriously: nobody can answer your question unless you specify, as a strict
minimum, input data, number of processors and type of parallelization that
trigger the error, and where the error occurs (at startup, later, in the
middle of the run, ...).
I compiled quantum espresso 5.4 with intel mpi and mkl 2016 update 3.
However, when I ran pw.x the following errors were reported:
...
MPIR_Get_contextid_sparse_group(1330): Too many communicators (0/16384 free on
this process; ignore_id=0)
Fatal error in PMPI_Cart_sub: Other MPI error, error
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