****************************************************************************************************
     Results at          0 MD step.
====================================================================================================
     Total energies (eV)
----------------------------------------------------------------------------------------------------
      -321.236861  -320.865893
      -321.104053  -320.719586
      -321.059856  -320.670049
      -321.015084  -320.621559
      -320.970748  -320.572786
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      -320.923873  -320.523315
      -320.923037  -320.522617
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      -319.687933  -319.729611
      -319.603653  -319.646698
      -319.452291  -319.502619
      -319.355072  -319.419199
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      -319.723494  -319.651125
      -319.713482  -319.652382
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      -319.356112  -319.506179
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====================================================================================================
     Forces (eV ang.^-1)
----------------------------------------------------------------------------------------------------
        -0.000647     0.014477
         0.004201     0.050891
         0.001756     0.067115
         0.002522    -0.031386
        -0.000261     0.066020
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         0.699468     0.594948
====================================================================================================
     Stress (kbar)
----------------------------------------------------------------------------------------------------
         0.216134    -0.787766
         0.064643    -0.572320
        -0.063374     2.159399
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        15.703258    16.095434
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