./iterations/neb0_image02_iter19_OSZICAR.out output for 39: 512-->524:: F2 + Si-NH-Si on surface slat V5 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.208932055065E+04 0.20893E+04 -0.11607E+05 1704 0.105E+03
DAV: 2 -0.142105999670E+03 -0.22314E+04 -0.21442E+04 2152 0.261E+02
DAV: 3 -0.462686018170E+03 -0.32058E+03 -0.31586E+03 1912 0.107E+02
DAV: 4 -0.476089459873E+03 -0.13403E+02 -0.13343E+02 1944 0.228E+01
DAV: 5 -0.476569484484E+03 -0.48002E+00 -0.47968E+00 2144 0.382E+00 0.434E+01
DAV: 6 -0.455444561212E+03 0.21125E+02 -0.14950E+02 2032 0.318E+01 0.408E+01
DAV: 7 -0.452862637245E+03 0.25819E+01 -0.42222E+01 1776 0.142E+01 0.220E+01
DAV: 8 -0.445939282463E+03 0.69234E+01 -0.98131E+00 1808 0.821E+00 0.132E+01
DAV: 9 -0.448005169494E+03 -0.20659E+01 -0.38019E+01 2096 0.108E+01 0.185E+01
DAV: 10 -0.445994796426E+03 0.20104E+01 -0.13054E+01 1872 0.363E+00 0.102E+01
DAV: 11 -0.445867092235E+03 0.12770E+00 -0.22599E-01 1928 0.894E-01 0.956E+00
DAV: 12 -0.445861285289E+03 0.58069E-02 -0.22928E-02 2064 0.477E-01 0.950E+00
DAV: 13 -0.446575412724E+03 -0.71413E+00 -0.42903E+00 2032 0.356E+00 0.188E+01
DAV: 14 -0.445149913348E+03 0.14255E+01 -0.91806E+00 1864 0.205E+00 0.520E+00
DAV: 15 -0.445320805904E+03 -0.17089E+00 -0.18526E-01 1912 0.116E+00 0.452E+00
DAV: 16 -0.445046482387E+03 0.27432E+00 -0.13164E-01 1976 0.114E+00 0.415E+00
DAV: 17 -0.444854602926E+03 0.19188E+00 -0.11835E-01 2016 0.725E-01 0.333E+00
DAV: 18 -0.444729023204E+03 0.12558E+00 -0.30122E-03 2072 0.477E-01 0.345E+00
DAV: 19 -0.444487922712E+03 0.24110E+00 -0.31894E-02 2352 0.674E-01 0.308E+00
DAV: 20 -0.444367709528E+03 0.12021E+00 -0.24836E-01 1960 0.668E-01 0.224E+00
DAV: 21 -0.444355554689E+03 0.12155E-01 -0.98515E-02 1856 0.429E-01 0.191E+00
DAV: 22 -0.444316377617E+03 0.39177E-01 -0.39960E-02 2048 0.434E-01 0.128E+00
DAV: 23 -0.444293520286E+03 0.22857E-01 -0.33092E-02 2136 0.774E-01 0.189E+00
DAV: 24 -0.444280692832E+03 0.12827E-01 -0.19775E-02 1872 0.265E-01 0.141E+00
DAV: 25 -0.444277717382E+03 0.29754E-02 -0.89732E-04 2128 0.612E-02 0.106E+00
DAV: 26 -0.444290304796E+03 -0.12587E-01 -0.34837E-03 1920 0.165E-01 0.109E+00
DAV: 27 -0.444334382764E+03 -0.44078E-01 -0.12892E-02 1952 0.420E-01 0.264E+00
DAV: 28 -0.444310091711E+03 0.24291E-01 -0.43322E-03 1872 0.166E-01 0.195E+00
DAV: 29 -0.444301485850E+03 0.86059E-02 -0.10451E-03 2104 0.109E-01 0.134E+00
DAV: 30 -0.444292528638E+03 0.89572E-02 -0.15293E-03 2104 0.158E-01 0.856E-01
DAV: 31 -0.444288285354E+03 0.42433E-02 -0.19589E-03 2000 0.154E-01 0.453E-01
DAV: 32 -0.444288210167E+03 0.75187E-04 -0.11912E-03 2008 0.114E-01 0.337E-01
DAV: 33 -0.444287329095E+03 0.88107E-03 -0.40345E-04 1928 0.649E-02 0.388E-01
DAV: 34 -0.444286588571E+03 0.74052E-03 -0.17040E-04 1920 0.476E-02 0.446E-01
DAV: 35 -0.444286360218E+03 0.22835E-03 -0.32113E-04 1864 0.528E-02 0.379E-01
DAV: 36 -0.444286090513E+03 0.26971E-03 -0.20422E-04 1928 0.369E-02 0.217E-01
DAV: 37 -0.444286772755E+03 -0.68224E-03 -0.68155E-05 1856 0.204E-02 0.186E-01
DAV: 38 -0.444287074017E+03 -0.30126E-03 -0.26685E-05 1424 0.148E-02 0.157E-01
DAV: 39 -0.444287503186E+03 -0.42917E-03 -0.19471E-04 1704 0.421E-02 0.567E-02
DAV: 40 -0.444287626144E+03 -0.12296E-03 -0.11817E-04 1952 0.296E-02 0.120E-01
DAV: 41 -0.444287483797E+03 0.14235E-03 -0.26896E-05 1312 0.117E-02 0.107E-01
DAV: 42 -0.444287483614E+03 0.18280E-06 -0.53243E-06 1008 0.699E-03
1 F= -.44428748E+03 E0= -.44427991E+03 d E =-.227200E-01