[Pw_forum] pw_langevin test
Ian Dunn
iansdunn at gmail.com
Sun Jun 19 01:48:16 CEST 2016
Hi,
I'm trying to run the tests for version 5.4.0 of QE. The two pw_langevin
tests fail as shown below. This is the result of running "make" from
within the test-suite directory. Please let me know if I can provide more
helpful information. Any idea how to fix these failing tests?
Best,
Ian
Program PWSCF v.5.4.0 starts on 18Jun2016 at 19:43:37
This program is part of the open-source Quantum ESPRESSO suite
for quantum simulation of materials; please cite
"P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009);
URL http://www.quantum-espresso.org",
in publications or presentations arising from this work. More details
at
http://www.quantum-espresso.org/quote
Parallel version (MPI), running on 1 processors
Reading input from langevin.in
Current dimensions of program PWSCF are:
Max number of different atomic species (ntypx) = 10
Max number of k-points (npk) = 40000
Max angular momentum in pseudopotentials (lmaxx) = 3
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
Error in routine read_ncpp (1):
pseudo file is empty or wrong
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
stopping ...
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20160618/35a92ed3/attachment.html>
More information about the users
mailing list