mirror of https://gitlab.com/QEF/q-e.git
66 lines
4.6 KiB
Plaintext
66 lines
4.6 KiB
Plaintext
diagonalizing the dynamical matrix ...
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q = 0.0000 0.0000 0.0000
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**************************************************************************
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freq ( 1) = -2.461517 [THz] = -82.107355 [cm-1]
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( -0.037966 0.000000 -0.044988 0.000000 -0.071726 0.000000 )
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( 0.039305 0.000000 0.007941 0.000000 -0.254390 0.000000 )
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( -0.054253 0.000000 0.010083 0.000000 0.592957 0.000000 )
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( 0.048778 0.000000 0.141377 0.000000 0.740309 0.000000 )
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freq ( 2) = -0.000000 [THz] = -0.000007 [cm-1]
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( 0.174267 0.000000 -0.009227 0.000000 0.210637 0.000000 )
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( -0.195996 0.000000 0.093391 0.000000 -0.305327 0.000000 )
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( 0.174676 0.000000 0.744074 -0.000000 -0.065234 0.000000 )
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( -0.195856 0.000000 -0.374470 0.000000 -0.133480 0.000000 )
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freq ( 3) = -0.000000 [THz] = -0.000004 [cm-1]
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( -0.304571 0.000000 -0.237643 0.000000 0.350898 0.000000 )
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( -0.417926 0.000000 -0.162432 0.000000 0.218218 0.000000 )
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( -0.304463 0.000000 -0.188436 0.000000 0.161677 0.000000 )
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( -0.418004 0.000000 -0.192966 0.000000 0.335646 0.000000 )
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freq ( 4) = -0.000000 [THz] = -0.000002 [cm-1]
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( 0.056895 0.000000 -0.780533 0.000000 -0.419672 0.000000 )
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( -0.080216 0.000000 0.253712 0.000000 -0.035619 0.000000 )
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( 0.057088 0.000000 -0.062510 0.000000 -0.268477 0.000000 )
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( -0.079871 0.000000 -0.191852 0.000000 -0.130003 0.000000 )
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freq ( 5) = 0.000000 [THz] = 0.000003 [cm-1]
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( 0.177631 0.000000 -0.165764 0.000000 0.073160 0.000000 )
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( 0.123714 0.000000 -0.594907 0.000000 -0.258339 0.000000 )
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( 0.177649 0.000000 -0.496340 0.000000 -0.221158 0.000000 )
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( 0.123441 0.000000 -0.389751 0.000000 -0.075439 0.000000 )
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freq ( 6) = 0.000000 [THz] = 0.000004 [cm-1]
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( -0.249962 0.000000 0.184591 0.000000 -0.222790 0.000000 )
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( -0.266804 0.000000 -0.011809 0.000000 -0.362334 0.000000 )
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( -0.249995 0.000000 -0.319520 0.000000 -0.546180 0.000000 )
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( -0.267156 0.000000 0.301232 0.000000 -0.161817 0.000000 )
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freq ( 7) = 0.000000 [THz] = 0.000008 [cm-1]
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( 0.225163 0.000000 -0.037970 0.000000 0.236233 0.000000 )
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( -0.023409 0.000000 0.180524 0.000000 -0.023790 0.000000 )
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( 0.225349 0.000000 -0.453700 0.000000 -0.481075 0.000000 )
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( -0.023929 0.000000 0.438840 0.000000 0.420877 0.000000 )
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freq ( 8) = 1.104143 [THz] = 36.830232 [cm-1]
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( -0.002646 0.000000 0.112594 0.000000 0.008725 0.000000 )
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( 0.003843 0.000000 0.214909 0.000000 -0.043849 0.000000 )
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( 0.002629 0.000000 -0.562171 0.000000 0.140154 0.000000 )
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( -0.007524 0.000000 -0.776763 0.000000 0.003441 0.000000 )
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freq ( 9) = 4.622459 [THz] = 154.188629 [cm-1]
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( 0.289096 0.000000 0.191034 0.000000 -0.351403 0.000000 )
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( -0.312879 0.000000 -0.158698 0.000000 0.242361 0.000000 )
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( 0.330023 0.000000 0.117350 0.000000 -0.120689 0.000000 )
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( -0.232793 0.000000 -0.249550 0.000000 0.566488 0.000000 )
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freq ( 10) = 5.406377 [THz] = 180.337315 [cm-1]
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( -0.195681 0.000000 -0.006479 0.000000 0.011789 0.000000 )
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( -0.138595 0.000000 0.006007 0.000000 -0.009833 0.000000 )
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( 0.746408 0.000000 -0.005698 0.000000 0.007586 0.000000 )
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( 0.620218 0.000000 0.007629 0.000000 -0.015583 0.000000 )
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freq ( 11) = 8.179427 [THz] = 272.836305 [cm-1]
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( -0.219661 0.000000 0.006247 0.000000 0.002071 0.000000 )
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( 0.231946 0.000000 -0.002462 0.000000 0.025384 0.000000 )
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( 0.041922 0.000000 0.330844 0.000000 -0.626786 0.000000 )
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( -0.092144 0.000000 -0.346318 0.000000 0.514543 0.000000 )
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freq ( 12) = 10.160311 [THz] = 338.911490 [cm-1]
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( 0.077957 0.000000 0.000734 0.000000 0.007272 0.000000 )
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( -0.109932 0.000000 0.003730 0.000000 0.007093 0.000000 )
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( -0.602764 0.000000 0.094210 0.000000 -0.198393 0.000000 )
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( 0.733489 0.000000 -0.112463 0.000000 0.139667 0.000000 )
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**************************************************************************
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