./iterations/neb0_image02_iter44_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 0.209749116285E+04 0.20975E+04 -0.11600E+05 1696 0.105E+03
DAV: 2 -0.139638818813E+03 -0.22371E+04 -0.21500E+04 2152 0.262E+02
DAV: 3 -0.461770045529E+03 -0.32213E+03 -0.31842E+03 1880 0.107E+02
DAV: 4 -0.475566228854E+03 -0.13796E+02 -0.13579E+02 1960 0.229E+01
DAV: 5 -0.476075594635E+03 -0.50937E+00 -0.50898E+00 2112 0.389E+00 0.434E+01
DAV: 6 -0.456821766823E+03 0.19254E+02 -0.19582E+02 2040 0.317E+01 0.411E+01
DAV: 7 -0.452217067712E+03 0.46047E+01 -0.42260E+01 1776 0.141E+01 0.220E+01
DAV: 8 -0.445346691853E+03 0.68704E+01 -0.98554E+00 1816 0.800E+00 0.106E+01
DAV: 9 -0.445394696776E+03 -0.48005E-01 -0.10399E+01 1928 0.660E+00 0.907E+00
DAV: 10 -0.444658819197E+03 0.73588E+00 -0.89541E-01 1888 0.234E+00 0.662E+00
DAV: 11 -0.446556282064E+03 -0.18975E+01 -0.23951E+01 2024 0.408E+00 0.139E+01
DAV: 12 -0.444167025578E+03 0.23893E+01 -0.10309E+00 2008 0.329E+00 0.127E+00
DAV: 13 -0.444328162392E+03 -0.16114E+00 -0.19966E-01 1896 0.862E-01 0.534E-01
DAV: 14 -0.444343357348E+03 -0.15195E-01 -0.15606E-02 2144 0.333E-01 0.394E-01
DAV: 15 -0.444348412922E+03 -0.50556E-02 -0.56970E-03 1872 0.222E-01 0.165E-01
DAV: 16 -0.444350651760E+03 -0.22388E-02 -0.18936E-03 1952 0.126E-01 0.115E-01
DAV: 17 -0.444352272582E+03 -0.16208E-02 -0.85158E-04 1904 0.766E-02 0.153E-01
DAV: 18 -0.444353051496E+03 -0.77891E-03 -0.29404E-04 1880 0.477E-02 0.766E-02
DAV: 19 -0.444354780158E+03 -0.17287E-02 -0.21025E-04 1856 0.504E-02 0.108E-01
DAV: 20 -0.444356609333E+03 -0.18292E-02 -0.37823E-04 1832 0.399E-02 0.365E-02
DAV: 21 -0.444357473147E+03 -0.86381E-03 -0.17189E-04 1848 0.304E-02 0.301E-02
DAV: 22 -0.444357886915E+03 -0.41377E-03 -0.49664E-05 1680 0.153E-02 0.133E-02
DAV: 23 -0.444358110951E+03 -0.22404E-03 -0.32662E-05 1488 0.135E-02 0.117E-02
DAV: 24 -0.444358268220E+03 -0.15727E-03 -0.18511E-05 1392 0.880E-03 0.488E-03
DAV: 25 -0.444358310029E+03 -0.41809E-04 -0.34632E-06 1096 0.505E-03 0.330E-03
DAV: 26 -0.444358343184E+03 -0.33156E-04 -0.46515E-06 1072 0.493E-03 0.465E-03
DAV: 27 -0.444358358007E+03 -0.14823E-04 -0.98312E-07 960 0.334E-03 0.227E-03
DAV: 28 -0.444358371257E+03 -0.13249E-04 -0.20760E-06 1040 0.364E-03 0.149E-03
DAV: 29 -0.444358376119E+03 -0.48624E-05 -0.42524E-07 936 0.171E-03
1 F= -.44435838E+03 E0= -.44435217E+03 d E =-.186081E-01