./iterations/neb0_image09_iter51_OSZICAR.out output for 40: 572-->565: F2 + F3Si-NF-SiF3, to SiF4 + F3Si-NF2 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.797781404607E+03 0.79778E+03 -0.25963E+04 912 0.101E+03
DAV: 2 0.102111919470E+03 -0.69567E+03 -0.67841E+03 1088 0.282E+02
DAV: 3 -0.636391291112E+02 -0.16575E+03 -0.16544E+03 843 0.155E+02
DAV: 4 -0.681113006760E+02 -0.44722E+01 -0.44556E+01 896 0.290E+01
DAV: 5 -0.681637256820E+02 -0.52425E-01 -0.52291E-01 918 0.309E+00 0.197E+01
DAV: 6 -0.635860183413E+02 0.45777E+01 -0.18786E+01 873 0.217E+01 0.109E+01
DAV: 7 -0.634377652570E+02 0.14825E+00 -0.90646E-01 952 0.527E+00 0.397E+00
DAV: 8 -0.634370415955E+02 0.72366E-03 -0.88541E-02 872 0.196E+00 0.136E+00
DAV: 9 -0.634483976070E+02 -0.11356E-01 -0.17615E-02 918 0.888E-01 0.320E-01
DAV: 10 -0.634503742956E+02 -0.19767E-02 -0.42451E-03 923 0.473E-01 0.152E-01
DAV: 11 -0.634512883216E+02 -0.91403E-03 -0.53284E-04 864 0.168E-01 0.707E-02
DAV: 12 -0.634525435176E+02 -0.12552E-02 -0.31963E-04 844 0.129E-01 0.303E-02
DAV: 13 -0.634533362592E+02 -0.79274E-03 -0.11561E-04 827 0.816E-02 0.287E-02
DAV: 14 -0.634539485647E+02 -0.61231E-03 -0.81187E-05 809 0.570E-02 0.130E-02
DAV: 15 -0.634542269415E+02 -0.27838E-03 -0.24472E-05 691 0.359E-02 0.504E-03
DAV: 16 -0.634544086471E+02 -0.18171E-03 -0.13955E-05 601 0.197E-02 0.414E-03
DAV: 17 -0.634545281995E+02 -0.11955E-03 -0.73734E-06 630 0.132E-02 0.269E-03
DAV: 18 -0.634545778878E+02 -0.49688E-04 -0.27671E-06 651 0.640E-03 0.123E-03
DAV: 19 -0.634546103427E+02 -0.32455E-04 -0.20401E-06 609 0.688E-03 0.139E-03
DAV: 20 -0.634546183015E+02 -0.79588E-05 -0.50450E-07 526 0.331E-03
1 F= -.63454618E+02 E0= -.63458484E+02 d E =0.115964E-01