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Re: [abinit-forum] irdwfk problem in v. 5.3.4


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  • From: "Anglade Pierre-Matthieu" <anglade@gmail.com>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] irdwfk problem in v. 5.3.4
  • Date: Tue, 14 Aug 2007 08:44:20 +0200
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Dear Joseph

Amazing. I usually get almost this exact message when I switch from
big endian to little endian computer and messed up the endianness
variable. However you do not mention such nasty thing, do you.
Sometimes when I can't get the expected result with irdwfk, I use
getwfk instead although this is supposed to give the same result. Have
you tryed this ?

regards


PMA


On 8/13/07, jzwanzig@dal.ca <jzwanzig@dal.ca> wrote:
> Dear Colleagues,
>
> somehow I think I've had this problem before but am not sure. At any rate,
> I am doing response function calculations similar to tutorial 2 on response
> functions. In one run I generate the ground state wavefunction. In another
> run I use nqpt = 1 and a finite qpt, and use irdwfk = 1 to read in the
> groundstate wavefunction (having changed the name from foo_WFK to
> fooi_WFK). The system finds the file, opens it, reads the header, and dies
> with the following message:
> -P-0000
> -P-0000
> ================================================================================
> -P-0000
> -P-0000 - hdr_check: checking restart file header for consistency
> -
> -P-0000
> -P-0000
> -P-0000 current calculation restart file
> -P-0000 ------------------- ------------
> -P-0000
> -P-0000 calculation expects a wf_planewave | input file contains a
> wf_planewave
> -P-0000 . ABINIT code version 5.3.4 | ABINIT code version
> -P-0000
> -P-0000 hdr_check: BUG -
> -P-0000 input fform= 2 differs from disk file fform= 0.
> -P-0000
> -P-0000 leave_new : decision taken to exit ...
> -P-0000 leave_new : synchronization done...
> -P-0000 leave_new : exiting...
>
>
> Any suggestions?
>
> thanks,
> Joe
>


--
Pierre-Matthieu Anglade



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