./iterations/neb0_image09_iter69_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 0.798235319158E+03 0.79824E+03 -0.25968E+04 912 0.101E+03
DAV: 2 0.102056027434E+03 -0.69618E+03 -0.67890E+03 1096 0.282E+02
DAV: 3 -0.635639173881E+02 -0.16562E+03 -0.16530E+03 835 0.155E+02
DAV: 4 -0.681329123094E+02 -0.45690E+01 -0.45545E+01 904 0.291E+01
DAV: 5 -0.681849258428E+02 -0.52014E-01 -0.51881E-01 923 0.309E+00 0.198E+01
DAV: 6 -0.636166212937E+02 0.45683E+01 -0.18790E+01 846 0.217E+01 0.109E+01
DAV: 7 -0.634702494092E+02 0.14637E+00 -0.91217E-01 944 0.525E+00 0.398E+00
DAV: 8 -0.634695675313E+02 0.68188E-03 -0.87530E-02 875 0.194E+00 0.136E+00
DAV: 9 -0.634803690664E+02 -0.10802E-01 -0.17422E-02 923 0.895E-01 0.318E-01
DAV: 10 -0.634825297460E+02 -0.21607E-02 -0.45271E-03 918 0.482E-01 0.149E-01
DAV: 11 -0.634834504107E+02 -0.92066E-03 -0.56745E-04 864 0.173E-01 0.725E-02
DAV: 12 -0.634848118328E+02 -0.13614E-02 -0.31863E-04 844 0.123E-01 0.315E-02
DAV: 13 -0.634857067451E+02 -0.89491E-03 -0.12854E-04 827 0.805E-02 0.301E-02
DAV: 14 -0.634863569481E+02 -0.65020E-03 -0.92957E-05 799 0.573E-02 0.130E-02
DAV: 15 -0.634866435293E+02 -0.28658E-03 -0.26610E-05 763 0.329E-02 0.544E-03
DAV: 16 -0.634868317388E+02 -0.18821E-03 -0.11986E-05 612 0.185E-02 0.409E-03
DAV: 17 -0.634869459937E+02 -0.11425E-03 -0.62405E-06 630 0.115E-02 0.250E-03
DAV: 18 -0.634870091745E+02 -0.63181E-04 -0.33600E-06 630 0.686E-03 0.107E-03
DAV: 19 -0.634870413539E+02 -0.32179E-04 -0.17393E-06 614 0.572E-03 0.111E-03
DAV: 20 -0.634870477392E+02 -0.63853E-05 -0.41516E-07 475 0.282E-03
1 F= -.63487048E+02 E0= -.63490913E+02 d E =0.115964E-01