[CP2K:4719] dbcsr error when applying periodic efield

Ole Schütt o... at schuett.name
Wed Oct 23 16:38:59 CEST 2013


Dear David,

would you mind sending me the other files required to run your input 
(e.g. off the mailing-list)?
Then I could try to reproduce the problem.

-Ole


On 2013-10-23 16:22, David Stelter wrote:
> Hi All,
> 
> I am trying to run a 10-mer stack of DNA with applied electric field.
> However, when applying the field (PERIODIC_EFIELD) I get a dbcsr and
> libdbcsr error which from my understanding is a bug in cp2k or a
> problem with the compilation on the machine.
> 
> I do not have access to the compilation of cp2k on the machine, but
> have tried it on an IBM Bladecenter and BlueGene/Q both obtaining the
> same error. Both machines are running cp2k 2.4. I've also done a test
> with the field applied to a single water which runs fine on both
> machines. I've attached both my input and output file.
> 
> Thanks,
> David
> 
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