1 2 Program PROJWFC v.6.0 (svn rev. 13286) starts on 7Feb2017 at 15:35:55 3 4 This program is part of the open-source Quantum ESPRESSO suite 5 for quantum simulation of materials; please cite 6 "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); 7 URL http://www.quantum-espresso.org", 8 in publications or presentations arising from this work. More details at 9 http://www.quantum-espresso.org/quote 10 11 Parallel version (MPI), running on 2 processors 12 R & G space division: proc/nbgrp/npool/nimage = 2 13 14 Reading data from directory: 15 /home/pietro/espresso-svn/tempdir/AlAs110.save 16 17 Info: using nr1, nr2, nr3 values from input 18 19 Info: using nr1, nr2, nr3 values from input 20 21 IMPORTANT: XC functional enforced from input : 22 Exchange-correlation = SLA PZ NOGX NOGC ( 1 1 0 0 0 0) 23 Any further DFT definition will be discarded 24 Please, verify this is what you really want 25 26 27 Parallelization info 28 -------------------- 29 sticks: dense smooth PW G-vecs: dense smooth PW 30 Min 174 174 54 12296 12296 2232 31 Max 175 175 55 12311 12311 2237 32 Sum 349 349 109 24607 24607 4469 33 34 35 Gaussian broadening (read from input): ngauss,degauss= 0 0.010000 36 37 38 Calling projwave_boxes .... 39 40 Box # 1 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.129807E-01 elec 41 Box # 2 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.146365E-02 elec 42 Box # 3 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.224744E-03 elec 43 Box # 4 : vol 0.222222 % = 7.717500 (a.u.)^3; 0.267744E-01 elec 44 Box # 5 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.283967E-04 elec 45 Box # 6 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.772767E-05 elec 46 Box # 7 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.454268E-05 elec 47 Box # 8 : vol 0.222222 % = 7.717500 (a.u.)^3; 0.813014E-04 elec 48 49 PROJWFC : 0.87s CPU 0.89s WALL 50 51 52 This run was terminated on: 15:35:56 7Feb2017 53 54=------------------------------------------------------------------------------= 55 JOB DONE. 56=------------------------------------------------------------------------------= 57