[Pw_forum] matdyn file corrupted? Error in routine readmat (1): mismatch in reading file
weeliat
owl1sg at yahoo.com
Sat Mar 22 02:19:18 CET 2014
Dear All,
I got the following error msg when running dynmat.x (ver 5.0.2) on a matdyn file to get the eigenvectors/values.
Reading Dynamical Matrix from file matdyn
%%%%%%%%%%%%%%%%%%%%%%%
Error in routine readmat (1):
mismatch in reading file
%%%%%%%%%%%%%%%%%%%%%%%
stopping ...
I compared this matdyn file with other matdyn files that i have but found nothing structurally different.
I wonder if somehow this matdyn file is corrupted and if there is a way to recreate this file as i have all the previous "raw" output (i.e., all the output files from phcg.x)? I have considered to rerun this calculation to get a new matdyn but it took 1 month for phcg.x to finish and generate this matdyn file for my 150-atom system.
Please help.
Thanks,
wee liat
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20140321/9c4a66c2/attachment.html>
More information about the users
mailing list