[Pw_forum] Error in routine pw_readfile: error opening xml data file

Juliana Morbec jmmorbec at gmail.com
Wed Feb 4 18:14:31 CET 2015


Dear All.

I am trying to perform vc-relax calculations (with version 5.1.1), but when
I try to restart the calculations I got the following error message:

 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     Error in routine pw_readfile (1):
     error opening xml data file
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%

I have tried this calculation in two different machines and got the same
error. I am sending here my input and output files.

Could someone help me with this problem, please?

Thank you,

Dr. Juliana M. Morbec
Postdoctoral Researcher
Institute for Molecular Engineering, The University of Chicago
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20150204/42196d36/attachment.html>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: Ta3N5.in
Type: application/octet-stream
Size: 5618 bytes
Desc: not available
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20150204/42196d36/attachment.obj>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: Ta3N5.out
Type: application/octet-stream
Size: 2091 bytes
Desc: not available
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20150204/42196d36/attachment-0001.obj>


More information about the users mailing list