The ABINIT Users Mailing List ( CLOSED )

[Masayoshi Mikami <mmikami@rc.m-kagaku.co.jp>]

Dear Matthieu,

I also have the compassion, after trying your input
(a bit modified to use Ag HGH-PP (11 valence electrons))
with abinit v.4.3.x  on MacOSX.  Segmentation fault !
With v.4.2.4, the same job seems to run on MacOSX...
(MacOSX: 10.3.3, Absoft Fortran v.8.0)

Regards,
Masayoshi

Attachment: hpux_bug.log.v433
Description: Binary data

On 2004/04/19, at 23:41, verstraete@pcpm.ucl.ac.be wrote:

> An identical input file (attached) gives a runtime error in abinit 
> 4.3.3
> and predecessors on a HP 8500, but runs fine on alpha machines. The 
> bug is
> in a line of invars0.f
>
> mxntypat =maxval(dtsets(1:ndtset_alloc)%ntypat)
>
> which returns mxntypat=0 despite the fact that dtsets(1)%ntypat=1.
> ndtset_alloc is 1, but this should be allowed since dtsets appears as 
> an
> array.
>
> If mxntypat is forced to one, a core dump results after the symmetries 
> are
> found (log attached).
>
> Any hints or compassion?
>
> Matthieu
>
>
> --
> ===================================================================
> Matthieu Verstraete               mailto:verstraete@pcpm.ucl.ac.be
> PCPM, Boltzmann, pl. Croix du Sud, 1            tel: 010/ 47 33 59
> B-1348 Louvain-la-Neuve  Belgium                fax: 010/ 47 34 
> 52<hpux_bug.in><hpux_bug.log>