
                         Program Version 6.0.1  -  RELEASE   -



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SOC CORRECTED TD-DFT/TDA-EXCITATION SPECTRA
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Generating SOC_CIS transition densities           ... done

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      SOC CORRECTED ABSORPTION SPECTRUM VIA TRANSITION ELECTRIC DIPOLE MOMENTS
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      Transition         Energy     Energy  Wavelength fosc(D2)      D2       |DX|      |DY|      |DZ|
                          (eV)      (cm-1)    (nm)                 (au**2)    (au)      (au)      (au)
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  0-1.0A  ->  1-3.0A    2.397072   19333.7   517.2   0.000000057   0.00000   0.00020   0.00094   0.00022
  0-1.0A  ->  2-3.0A    2.397121   19334.1   517.2   0.000019815   0.00034   0.01766   0.00503   0.00031
  0-1.0A  ->  3-3.0A    2.397136   19334.2   517.2   0.000004745   0.00008   0.00089   0.00078   0.00891
  0-1.0A  ->  4-3.0A    2.754401   22215.7   450.1   0.000040044   0.00059   0.00616   0.02248   0.00707
  0-1.0A  ->  5-3.0A    2.754424   22215.9   450.1   0.000003090   0.00005   0.00018   0.00652   0.00179
  0-1.0A  ->  6-3.0A    2.754511   22216.6   450.1   0.000002380   0.00004   0.00091   0.00527   0.00257
  0-1.0A  ->  7-1.0A    2.897981   23373.8   427.8   0.210791819   2.96893   0.47684   1.60650   0.40089
  0-1.0A  ->  8-3.0A    2.974164   23988.3   416.9   0.000023974   0.00033   0.00421   0.01693   0.00495
  0-1.0A  ->  9-3.0A    2.977181   24012.6   416.4   0.000216179   0.00296   0.04560   0.02922   0.00555
  0-1.0A  -> 10-3.0A    2.987730   24097.7   415.0   0.000946488   0.01293   0.02974   0.10584   0.02906
  0-1.0A  -> 11-3.0A    3.007102   24253.9   412.3   0.000121694   0.00165   0.01137   0.03809   0.00846
  0-1.0A  -> 12-3.0A    3.007449   24256.7   412.3   0.000109372   0.00148   0.03519   0.01499   0.00460
  0-1.0A  -> 13-3.0A    3.015008   24317.7   411.2   0.001006310   0.01362   0.03081   0.10858   0.02974
  0-1.0A  -> 14-1.1A    3.217583   25951.6   385.3   0.157859737   2.00255   1.31897   0.51152   0.03492
  0-1.0A  -> 15-2.8A    3.300139   26617.4   375.7   0.004877841   0.06033   0.23426   0.00451   0.07370
  0-1.0A  -> 16-3.0A    3.314805   26735.7   374.0   0.000654890   0.00806   0.08676   0.01303   0.01917
  0-1.0A  -> 17-3.0A    3.329765   26856.4   372.4   0.000060769   0.00074   0.00037   0.02709   0.00334
  0-1.0A  -> 18-2.9A    3.340524   26943.1   371.2   0.000102279   0.00125   0.02107   0.01106   0.02614
  0-1.0A  -> 19-3.0A    3.348878   27010.5   370.2   0.000484137   0.00590   0.06209   0.03887   0.02312
  0-1.0A  -> 20-3.0A    3.351568   27032.2   369.9   0.000030600   0.00037   0.00137   0.00014   0.01926
  0-1.0A  -> 21-2.9A    3.358163   27085.4   369.2   0.000546094   0.00664   0.05067   0.04281   0.04731
  0-1.0A  -> 22-3.0A    3.375202   27222.8   367.3   0.000028533   0.00035   0.01752   0.00522   0.00328
  0-1.0A  -> 23-3.0A    3.381692   27275.2   366.6   0.000135620   0.00164   0.02746   0.02741   0.01148
  0-1.0A  -> 24-3.0A    3.384501   27297.8   366.3   0.000549713   0.00663   0.07494   0.03045   0.00927
  0-1.0A  -> 25-3.0A    3.387257   27320.1   366.0   0.000149531   0.00180   0.02910   0.02976   0.00836
  0-1.0A  -> 26-3.0A    3.411899   27518.8   363.4   0.000035140   0.00042   0.01137   0.01355   0.01037
  0-1.0A  -> 27-1.5A    3.534491   28507.6   350.8   0.007668087   0.08855   0.11459   0.20046   0.18771
  0-1.0A  -> 28-2.4A    3.568858   28784.8   347.4   0.001681461   0.01923   0.02872   0.12610   0.05005
  0-1.0A  -> 29-3.0A    3.574505   28830.3   346.9   0.000033242   0.00038   0.00748   0.01695   0.00602
  0-1.0A  -> 30-3.0A    3.575877   28841.4   346.7   0.000060986   0.00070   0.00323   0.02178   0.01454
  0-1.0A  -> 31-1.6A    3.581080   28883.4   346.2   0.003244969   0.03699   0.08786   0.15574   0.07080
  0-1.0A  -> 32-3.0A    3.654437   29475.0   339.3   0.000066597   0.00074   0.02186   0.00444   0.01569
  0-1.0A  -> 33-3.0A    3.655277   29481.8   339.2   0.000070094   0.00078   0.02648   0.00327   0.00841
  0-1.0A  -> 34-3.0A    3.655773   29485.8   339.1   0.000044276   0.00049   0.00538   0.01653   0.01386
  0-1.0A  -> 35-1.3A    3.713287   29949.7   333.9   0.001599311   0.01758   0.00222   0.11849   0.05946
  0-1.0A  -> 36-2.7A    3.736670   30138.3   331.8   0.000636911   0.00696   0.02831   0.02857   0.07307
  0-1.0A  -> 37-1.1A    3.752606   30266.8   330.4   0.166118073   1.80687   1.28125   0.39563   0.09353
  0-1.0A  -> 38-2.9A    3.827622   30871.9   323.9   0.007048001   0.07516   0.26204   0.07521   0.02896
  0-1.0A  -> 39-3.0A    3.830696   30896.6   323.7   0.000283747   0.00302   0.01921   0.05031   0.01109
  0-1.0A  -> 40-2.9A    3.833791   30921.6   323.4   0.000475065   0.00506   0.03763   0.05760   0.01801
  0-1.0A  -> 41-2.9A    3.847192   31029.7   322.3   0.000472685   0.00501   0.02412   0.02489   0.06175
  0-1.0A  -> 42-2.7A    3.849932   31051.8   322.0   0.001782542   0.01890   0.13637   0.00150   0.01727
  0-1.0A  -> 43-2.9A    3.859671   31130.3   321.2   0.000366111   0.00387   0.03254   0.05280   0.00497
  0-1.0A  -> 44-3.0A    3.862579   31153.8   321.0   0.000138879   0.00147   0.02164   0.03050   0.00832
  0-1.0A  -> 45-2.9A    3.867500   31193.5   320.6   0.003216677   0.03395   0.18038   0.00623   0.03705
  0-1.0A  -> 46-2.9A    3.875929   31261.5   319.9   0.001147911   0.01209   0.09898   0.04656   0.01112
  0-1.0A  -> 47-2.8A    3.882920   31317.9   319.3   0.000226892   0.00239   0.03480   0.02743   0.02054
  0-1.0A  -> 48-3.0A    3.885374   31337.7   319.1   0.000385211   0.00405   0.06304   0.00513   0.00678
  0-1.0A  -> 49-1.6A    3.896541   31427.7   318.2   0.001432958   0.01501   0.07350   0.07091   0.06767
  0-1.0A  -> 50-2.9A    3.918952   31608.5   316.4   0.002943215   0.03065   0.16693   0.03166   0.04228
  0-1.0A  -> 51-3.0A    3.923067   31641.7   316.0   0.000079302   0.00083   0.01227   0.02539   0.00550
  0-1.0A  -> 52-2.9A    3.924268   31651.4   315.9   0.000206165   0.00214   0.00791   0.03773   0.02565
  0-1.0A  -> 53-1.4A    3.952392   31878.2   313.7   0.004608845   0.04760   0.01089   0.15428   0.15387
  0-1.0A  -> 54-3.0A    3.985923   32148.6   311.1   0.000056173   0.00058   0.00607   0.02320   0.00062
  0-1.0A  -> 55-3.0A    3.986085   32149.9   311.0   0.000006206   0.00006   0.00218   0.00536   0.00549
  0-1.0A  -> 56-2.9A    3.987672   32162.7   310.9   0.000063350   0.00065   0.01047   0.00854   0.02158
  0-1.0A  -> 57-2.7A    4.039781   32583.0   306.9   0.018079863   0.18268   0.39498   0.16225   0.01850
  0-1.0A  -> 58-2.8A    4.058667   32735.4   305.5   0.001891534   0.01902   0.06235   0.11814   0.03433
  0-1.0A  -> 59-3.0A    4.059635   32743.2   305.4   0.000014206   0.00014   0.00987   0.00672   0.00034
  0-1.0A  -> 60-1.0A    4.086207   32957.5   303.4   0.057896946   0.57833   0.24431   0.68331   0.22743
  0-1.0A  -> 61-2.9A    4.110998   33157.4   301.6   0.005397890   0.05359   0.22173   0.06205   0.02408
  0-1.0A  -> 62-2.7A    4.116153   33199.0   301.2   0.001607472   0.01594   0.04045   0.07718   0.09136
  0-1.0A  -> 63-3.0A    4.119689   33227.5   301.0   0.000491494   0.00487   0.06719   0.01837   0.00422
  0-1.0A  -> 64-1.8A    4.144885   33430.8   299.1   0.009547862   0.09402   0.06305   0.21984   0.20426

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      SOC CORRECTED ABSORPTION SPECTRUM VIA TRANSITION VELOCITY DIPOLE MOMENTS
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      Transition         Energy     Energy  Wavelength fosc(P2)      P2       |PX|      |PY|      |PZ|
                          (eV)      (cm-1)    (nm)                 (au**2)    (au)      (au)      (au)
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TOTAL RUN TIME: 1 hour 23 minutes and 12 seconds
