Program PWSCF v.5.1.2 starts on 20May2015 at 14:34:28 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 & OpenMP), running on 24 processor cores Number of MPI processes: 24 Threads/MPI process: 1 R & G space division: proc/nbgrp/npool/nimage = 24 Waiting for input... Reading input from standard input Warning: card &CELL ignored Warning: card CELL_DYNAMICS='BFGS', ignored Warning: card PRESS_CONV_THR=0.1D-0, ignored Warning: card / ignored 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 cell_base_init (2): lattice parameter specified twice %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% stopping ... Application 52402908 exit codes: 134 Application 52402908 resources: utime ~1s, stime ~20s, Rss ~34068, inblocks ~36202, outblocks ~96988