./iterations/neb0_image01_iter64_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 0.208818878928E+04 0.20882E+04 -0.11606E+05 1704 0.105E+03
DAV: 2 -0.141263049060E+03 -0.22295E+04 -0.21420E+04 2144 0.261E+02
DAV: 3 -0.461738929471E+03 -0.32048E+03 -0.31684E+03 1896 0.107E+02
DAV: 4 -0.475284956615E+03 -0.13546E+02 -0.13319E+02 1944 0.227E+01
DAV: 5 -0.475824505293E+03 -0.53955E+00 -0.53918E+00 2120 0.394E+00 0.435E+01
DAV: 6 -0.458834589621E+03 0.16990E+02 -0.24120E+02 2048 0.319E+01 0.411E+01
DAV: 7 -0.449921182615E+03 0.89134E+01 -0.41658E+01 1756 0.139E+01 0.198E+01
DAV: 8 -0.445438407461E+03 0.44828E+01 -0.82813E+00 1800 0.714E+00 0.114E+01
DAV: 9 -0.446646615655E+03 -0.12082E+01 -0.26335E+01 2092 0.803E+00 0.101E+01
DAV: 10 -0.446113418924E+03 0.53320E+00 -0.15026E+00 1824 0.227E+00 0.911E+00
DAV: 11 -0.444926477588E+03 0.11869E+01 -0.17800E+00 1992 0.240E+00 0.582E+00
DAV: 12 -0.444762007216E+03 0.16447E+00 -0.58165E+00 2040 0.262E+00 0.120E+01
DAV: 13 -0.444530514337E+03 0.23149E+00 -0.99348E+00 1968 0.226E+00 0.379E+00
DAV: 14 -0.444520876766E+03 0.96376E-02 -0.11804E-01 1864 0.717E-01 0.344E+00
DAV: 15 -0.444397089818E+03 0.12379E+00 -0.20250E-02 2000 0.501E-01 0.136E+00
DAV: 16 -0.444403748050E+03 -0.66582E-02 -0.12568E-02 1864 0.345E-01 0.803E-01
DAV: 17 -0.444416298558E+03 -0.12551E-01 -0.10244E-01 2112 0.348E-01 0.691E-01
DAV: 18 -0.444420763309E+03 -0.44648E-02 -0.41179E-03 1904 0.167E-01 0.324E-01
DAV: 19 -0.444420950137E+03 -0.18683E-03 -0.14526E-03 1880 0.841E-02 0.172E-01
DAV: 20 -0.444422103513E+03 -0.11534E-02 -0.53598E-04 1944 0.619E-02 0.627E-02
DAV: 21 -0.444423059020E+03 -0.95551E-03 -0.22645E-04 1800 0.370E-02 0.647E-02
DAV: 22 -0.444424081534E+03 -0.10225E-02 -0.18946E-04 1920 0.379E-02 0.141E-01
DAV: 23 -0.444424082021E+03 -0.48688E-06 -0.16052E-04 1968 0.386E-02 0.263E-02
DAV: 24 -0.444424471430E+03 -0.38941E-03 -0.43760E-05 1664 0.164E-02 0.217E-02
DAV: 25 -0.444424952439E+03 -0.48101E-03 -0.10061E-04 1848 0.230E-02 0.403E-02
DAV: 26 -0.444425092984E+03 -0.14055E-03 -0.27949E-05 1480 0.176E-02 0.184E-02
DAV: 27 -0.444425168261E+03 -0.75277E-04 -0.27433E-05 1640 0.115E-02 0.102E-02
DAV: 28 -0.444425183804E+03 -0.15543E-04 -0.45053E-06 952 0.602E-03 0.705E-03
DAV: 29 -0.444425208826E+03 -0.25022E-04 -0.99143E-06 1136 0.834E-03 0.208E-02
DAV: 30 -0.444425218320E+03 -0.94935E-05 -0.22229E-06 992 0.407E-03
1 F= -.44442522E+03 E0= -.44441835E+03 d E =-.205996E-01