hi,
I asked about the error "unexpected no. of orbitals in left
electrode", Idid'n get any reply.can u tell me what is the exat reason ?
On Fri, Jul 6, 2012 at 2:18 AM, R.C.Pasianot <[email protected]> wrote:
>
> Hi,
>
> This issue has appeared many times before (search the archives).
> Probably your lapack/scalapack is buggy.
> Just a wild guess: are you running orbital-parallel a problem that
> is too small ?.
> Have you performed the tests bundled with the package ?.
>
> Bye,
>
> Roberto
>
>
>
> On Thu, 5 Jul 2012, Iván Pulido Sanchez wrote:
>
> Hi,
>>
>> When running siesta 3.1 (mpi support) in a cluster we are getting the
>> following errors:
>>
>> Error in Cholesky factorisation in cdiag
>>
>> mpirun has exited due to process rank 1 with PID xxxxx on
>> node xxxx exiting without calling "finalize". This may
>> have caused other processes in the application to be
>> terminated by signals sent by mpirun (as reported here).
>>
>>
>> The last one I think is a consequence of the first one, but I appreciate
>> any help or idea you have on the first error.
>>
>> Thanks.
>>
>> --
>> Iván José Pulido Sánchez
>> Estudiante de Física
>> Universidad Nacional de Colombia
>>
>
