mirror of https://gitlab.com/QEF/q-e.git
57 lines
2.3 KiB
Plaintext
57 lines
2.3 KiB
Plaintext
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Program PROJWFC v.6.0 (svn rev. 13286) starts on 7Feb2017 at 15:35:55
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This program is part of the open-source Quantum ESPRESSO suite
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for quantum simulation of materials; please cite
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"P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009);
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URL http://www.quantum-espresso.org",
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in publications or presentations arising from this work. More details at
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http://www.quantum-espresso.org/quote
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Parallel version (MPI), running on 2 processors
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R & G space division: proc/nbgrp/npool/nimage = 2
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Reading data from directory:
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/home/pietro/espresso-svn/tempdir/AlAs110.save
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Info: using nr1, nr2, nr3 values from input
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Info: using nr1, nr2, nr3 values from input
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IMPORTANT: XC functional enforced from input :
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Exchange-correlation = SLA PZ NOGX NOGC ( 1 1 0 0 0 0)
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Any further DFT definition will be discarded
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Please, verify this is what you really want
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Parallelization info
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--------------------
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sticks: dense smooth PW G-vecs: dense smooth PW
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Min 174 174 54 12296 12296 2232
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Max 175 175 55 12311 12311 2237
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Sum 349 349 109 24607 24607 4469
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Gaussian broadening (read from input): ngauss,degauss= 0 0.010000
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Calling projwave_boxes ....
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Box # 1 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.129807E-01 elec
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Box # 2 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.146365E-02 elec
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Box # 3 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.224744E-03 elec
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Box # 4 : vol 0.222222 % = 7.717500 (a.u.)^3; 0.267744E-01 elec
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Box # 5 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.283967E-04 elec
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Box # 6 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.772767E-05 elec
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Box # 7 : vol 0.055556 % = 1.929375 (a.u.)^3; 0.454268E-05 elec
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Box # 8 : vol 0.222222 % = 7.717500 (a.u.)^3; 0.813014E-04 elec
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PROJWFC : 0.87s CPU 0.89s WALL
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This run was terminated on: 15:35:56 7Feb2017
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=------------------------------------------------------------------------------=
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JOB DONE.
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=------------------------------------------------------------------------------=
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