iterations/neb0_image09_iter18_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 0.209579838194E+04 0.20958E+04 -0.11611E+05 1704 0.105E+03
DAV: 2 -0.141955978610E+03 -0.22378E+04 -0.21490E+04 2144 0.262E+02
DAV: 3 -0.466300482820E+03 -0.32434E+03 -0.32092E+03 1848 0.108E+02
DAV: 4 -0.479041005032E+03 -0.12741E+02 -0.12691E+02 1968 0.227E+01
DAV: 5 -0.479496091545E+03 -0.45509E+00 -0.45485E+00 2120 0.378E+00 0.427E+01
DAV: 6 -0.447283488759E+03 0.32213E+02 -0.14297E+02 2008 0.307E+01 0.270E+01
DAV: 7 -0.448824502486E+03 -0.15410E+01 -0.69655E+01 1888 0.112E+01 0.136E+01
DAV: 8 -0.446421803851E+03 0.24027E+01 -0.78678E+00 2464 0.800E+00 0.960E+00
DAV: 9 -0.446932329916E+03 -0.51053E+00 -0.21057E+01 2000 0.445E+00 0.539E+00
DAV: 10 -0.445908226984E+03 0.10241E+01 -0.85804E-01 2192 0.407E+00 0.203E+00
DAV: 11 -0.445937986180E+03 -0.29759E-01 -0.81882E-01 1888 0.147E+00 0.174E+00
DAV: 12 -0.445959044743E+03 -0.21059E-01 -0.76692E-01 1976 0.851E-01 0.286E+00
DAV: 13 -0.446051949008E+03 -0.92904E-01 -0.19950E+00 2408 0.101E+00 0.435E+00
DAV: 14 -0.445913207053E+03 0.13874E+00 -0.19221E-01 2040 0.662E-01 0.132E+00
DAV: 15 -0.445913748327E+03 -0.54127E-03 -0.97160E-02 2080 0.405E-01 0.495E-01
DAV: 16 -0.445917749243E+03 -0.40009E-02 -0.63704E-03 1816 0.200E-01 0.141E-01
DAV: 17 -0.445920162034E+03 -0.24128E-02 -0.18081E-03 2064 0.923E-02 0.461E-01
DAV: 18 -0.445921654450E+03 -0.14924E-02 -0.29603E-03 1880 0.949E-02 0.138E-01
DAV: 19 -0.445923731211E+03 -0.20768E-02 -0.79756E-04 1928 0.679E-02 0.197E-01
DAV: 20 -0.445925224203E+03 -0.14930E-02 -0.78365E-04 2064 0.676E-02 0.309E-02
DAV: 21 -0.445927009461E+03 -0.17853E-02 -0.30409E-04 1792 0.363E-02 0.261E-02
DAV: 22 -0.445927934833E+03 -0.92537E-03 -0.18250E-04 1776 0.264E-02 0.865E-02
DAV: 23 -0.445928164661E+03 -0.22983E-03 -0.95919E-05 1712 0.210E-02 0.146E-02
DAV: 24 -0.445928345244E+03 -0.18058E-03 -0.41406E-05 1624 0.151E-02 0.344E-02
DAV: 25 -0.445928417891E+03 -0.72646E-04 -0.16546E-05 1144 0.103E-02 0.115E-02
DAV: 26 -0.445928497513E+03 -0.79622E-04 -0.76335E-06 1104 0.740E-03 0.377E-03
DAV: 27 -0.445928550616E+03 -0.53104E-04 -0.71030E-06 1064 0.679E-03 0.471E-03
DAV: 28 -0.445928564558E+03 -0.13942E-04 -0.17233E-06 936 0.369E-03 0.440E-03
DAV: 29 -0.445928581232E+03 -0.16673E-04 -0.27343E-06 976 0.444E-03 0.776E-03
DAV: 30 -0.445928586014E+03 -0.47824E-05 -0.94474E-07 936 0.264E-03
1 F= -.44592859E+03 E0= -.44590300E+03 d E =-.767668E-01