mirror of https://gitlab.com/QEF/q-e.git
109 lines
4.1 KiB
Plaintext
109 lines
4.1 KiB
Plaintext
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Program Q2R v.6.0 (svn rev. 13188M) starts on 7Dec2016 at 16:44:46
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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 4 processors
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R & G space division: proc/nbgrp/npool/nimage = 4
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reading grid info from file al.disp.dyn0
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reading force constants from file al.disp.dyn1
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Dielectric Tensor not found
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nqs= 1
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q= 0.00000000 0.00000000 0.00000000
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reading force constants from file al.disp.dyn2
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nqs= 8
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q= -0.25000000 0.25000000 -0.25000000
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q= 0.25000000 -0.25000000 -0.25000000
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q= 0.25000000 -0.25000000 0.25000000
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q= 0.25000000 0.25000000 0.25000000
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q= -0.25000000 -0.25000000 -0.25000000
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q= -0.25000000 -0.25000000 0.25000000
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q= -0.25000000 0.25000000 0.25000000
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q= 0.25000000 0.25000000 -0.25000000
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reading force constants from file al.disp.dyn3
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nqs= 4
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q= 0.50000000 -0.50000000 0.50000000
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q= 0.50000000 0.50000000 0.50000000
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q= -0.50000000 0.50000000 0.50000000
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q= 0.50000000 0.50000000 -0.50000000
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reading force constants from file al.disp.dyn4
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nqs= 6
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q= 0.00000000 0.50000000 0.00000000
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q= 0.00000000 -0.50000000 0.00000000
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q= 0.50000000 0.00000000 0.00000000
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q= 0.00000000 0.00000000 0.50000000
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q= 0.00000000 0.00000000 -0.50000000
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q= -0.50000000 0.00000000 0.00000000
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reading force constants from file al.disp.dyn5
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nqs= 24
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q= 0.75000000 -0.25000000 0.75000000
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q= 0.75000000 -0.25000000 -0.75000000
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q= -0.75000000 -0.25000000 -0.75000000
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q= -0.75000000 -0.25000000 0.75000000
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q= -0.75000000 0.25000000 -0.75000000
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q= -0.25000000 0.75000000 -0.75000000
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q= -0.75000000 0.75000000 -0.25000000
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q= 0.75000000 0.25000000 0.75000000
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q= -0.75000000 0.25000000 0.75000000
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q= 0.75000000 0.25000000 -0.75000000
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q= -0.75000000 0.75000000 0.25000000
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q= -0.25000000 0.75000000 0.75000000
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q= 0.25000000 0.75000000 -0.75000000
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q= -0.25000000 -0.75000000 -0.75000000
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q= 0.75000000 0.75000000 -0.25000000
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q= 0.75000000 -0.75000000 0.25000000
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q= -0.75000000 -0.75000000 -0.25000000
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q= 0.25000000 -0.75000000 0.75000000
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q= -0.75000000 -0.75000000 0.25000000
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q= 0.25000000 0.75000000 0.75000000
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q= -0.25000000 -0.75000000 0.75000000
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q= 0.75000000 0.75000000 0.25000000
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q= 0.25000000 -0.75000000 -0.75000000
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q= 0.75000000 -0.75000000 -0.25000000
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reading force constants from file al.disp.dyn6
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nqs= 12
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q= 0.50000000 0.00000000 0.50000000
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q= -0.50000000 0.00000000 0.50000000
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q= -0.50000000 0.00000000 -0.50000000
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q= 0.50000000 0.00000000 -0.50000000
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q= 0.00000000 0.50000000 -0.50000000
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q= -0.50000000 0.50000000 0.00000000
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q= 0.00000000 0.50000000 0.50000000
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q= 0.00000000 -0.50000000 -0.50000000
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q= 0.50000000 0.50000000 0.00000000
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q= 0.50000000 -0.50000000 0.00000000
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q= -0.50000000 -0.50000000 0.00000000
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q= 0.00000000 -0.50000000 0.50000000
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reading force constants from file al.disp.dyn7
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nqs= 3
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q= 0.00000000 -1.00000000 0.00000000
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q= -1.00000000 0.00000000 0.00000000
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q= 0.00000000 0.00000000 -1.00000000
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reading force constants from file al.disp.dyn8
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nqs= 6
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q= -0.50000000 -1.00000000 0.00000000
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q= 0.00000000 1.00000000 0.50000000
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q= 0.00000000 -1.00000000 -0.50000000
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q= 0.50000000 1.00000000 0.00000000
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q= -1.00000000 -0.50000000 0.00000000
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q= 0.00000000 -0.50000000 -1.00000000
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q-space grid ok, #points = 64
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fft-check success (sum of imaginary terms < 10^-12)
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Q2R : 0.01s CPU 0.01s WALL
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This run was terminated on: 16:44:46 7Dec2016
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=------------------------------------------------------------------------------=
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JOB DONE.
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=------------------------------------------------------------------------------=
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