The ABINIT Users Mailing List ( CLOSED )

["Tonatiuh Rangel" <Tonatiuh.Rangel@uclouvain.be>]

Dear Zahra,
Could you send us the input file for the SCR?
I think this can help us to clarify your problem

Best
Tonatiuh


> Dera All,
> I strongly need your help! it is really emergency!
> I am already running a GW parallel calculations, using for stages by
> tgw2_1.in(up to 4), editting abinit samples to my desired ones. I
> really need your help. I try to insert some input variables in my
> input files and editting my job file by replacing abinip instead of
> abinis. I define gwpara variable in SCR calculation stage and npkpt in
> all input files,. the first stage is gone well, but at second one,
> calculations stop and give some messages like this:"time reversal
> symmetry is applies only when you use sequential version af abinit",
> or when I try some other times like this:"some processes are killed by
> mpirun"!
> I dont know what is the problem and I dont know what can I do to run my
> job.
> So, did any one do GW parallel before or can guess what is the
> problem? did any one know what are necessary input variables? what is
> a sample input file to do GW calculations parallel on a cluster? what
> should I do?
> Please, it is really vital to me to do it before Tuesday, please reply
> as soon as you can! I have to get it very soon!
> waiting for all your responses,
> Zahra
>
> --
> Regards
> Zahra Hooshmand
>
>
>
> --
> Regards
> Zahra Hooshmand
>