./iterations/neb0_image04_iter33_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 0.209040754887E+04 0.20904E+04 -0.11613E+05 1704 0.105E+03
DAV: 2 -0.141791619789E+03 -0.22322E+04 -0.21413E+04 2136 0.262E+02
DAV: 3 -0.466305957199E+03 -0.32451E+03 -0.32110E+03 1872 0.108E+02
DAV: 4 -0.478583321462E+03 -0.12277E+02 -0.12225E+02 1960 0.222E+01
DAV: 5 -0.479028795111E+03 -0.44547E+00 -0.44524E+00 2120 0.372E+00 0.432E+01
DAV: 6 -0.447227651465E+03 0.31801E+02 -0.14592E+02 2032 0.315E+01 0.375E+01
DAV: 7 -0.454305637251E+03 -0.70780E+01 -0.28573E+02 1912 0.136E+01 0.207E+01
DAV: 8 -0.448283267904E+03 0.60224E+01 -0.85384E+00 1800 0.751E+00 0.125E+01
DAV: 9 -0.445913948904E+03 0.23693E+01 -0.17545E+01 2008 0.111E+01 0.101E+01
DAV: 10 -0.445053724276E+03 0.86022E+00 -0.31951E+00 1904 0.341E+00 0.104E+01
DAV: 11 -0.444306730993E+03 0.74699E+00 -0.13066E+00 1984 0.184E+00 0.505E+00
DAV: 12 -0.444752210891E+03 -0.44548E+00 -0.10720E+01 2160 0.331E+00 0.699E+00
DAV: 13 -0.444072061233E+03 0.68015E+00 -0.10648E+00 2040 0.214E+00 0.220E+00
DAV: 14 -0.444077121507E+03 -0.50603E-02 -0.20906E-01 2048 0.971E-01 0.155E+00
DAV: 15 -0.444312959105E+03 -0.23584E+00 -0.10057E+00 1896 0.971E-01 0.605E+00
DAV: 16 -0.444053228933E+03 0.25973E+00 -0.12476E+00 1992 0.915E-01 0.111E+00
DAV: 17 -0.444086621827E+03 -0.33393E-01 -0.34295E-02 1920 0.371E-01 0.118E+00
DAV: 18 -0.444102269687E+03 -0.15648E-01 -0.13244E-02 2000 0.216E-01 0.170E+00
DAV: 19 -0.444084511410E+03 0.17758E-01 -0.89616E-03 1928 0.190E-01 0.939E-01
DAV: 20 -0.444087505114E+03 -0.29937E-02 -0.19460E-02 2008 0.169E-01 0.165E-01
DAV: 21 -0.444094708551E+03 -0.72034E-02 -0.25059E-03 1992 0.127E-01 0.431E-01
DAV: 22 -0.444095551899E+03 -0.84335E-03 -0.37795E-03 2024 0.908E-02 0.181E-01
DAV: 23 -0.444098384846E+03 -0.28329E-02 -0.69655E-04 1808 0.560E-02 0.267E-01
DAV: 24 -0.444099130794E+03 -0.74595E-03 -0.38748E-04 1888 0.331E-02 0.184E-01
DAV: 25 -0.444100003815E+03 -0.87302E-03 -0.45205E-04 1864 0.313E-02 0.735E-02
DAV: 26 -0.444100505694E+03 -0.50188E-03 -0.27045E-04 1744 0.214E-02 0.542E-02
DAV: 27 -0.444100722899E+03 -0.21720E-03 -0.38635E-05 1312 0.121E-02 0.212E-02
DAV: 28 -0.444100864450E+03 -0.14155E-03 -0.53471E-05 1472 0.140E-02 0.319E-02
DAV: 29 -0.444100911610E+03 -0.47160E-04 -0.10933E-05 1096 0.677E-03 0.230E-02
DAV: 30 -0.444100946226E+03 -0.34617E-04 -0.15027E-05 1072 0.861E-03 0.131E-02
DAV: 31 -0.444100963593E+03 -0.17366E-04 -0.47726E-06 936 0.545E-03 0.137E-02
DAV: 32 -0.444100971354E+03 -0.77607E-05 -0.10905E-06 952 0.284E-03
1 F= -.44410097E+03 E0= -.44407870E+03 d E =-.668251E-01