./iterations/neb0_image02_iter63_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 0.803815747672E+03 0.80382E+03 -0.25803E+04 904 0.101E+03
DAV: 2 0.108407347685E+03 -0.69541E+03 -0.67878E+03 1144 0.281E+02
DAV: 3 -0.597126560382E+02 -0.16812E+03 -0.16716E+03 848 0.154E+02
DAV: 4 -0.648594799103E+02 -0.51468E+01 -0.51321E+01 888 0.294E+01
DAV: 5 -0.649197551083E+02 -0.60275E-01 -0.60146E-01 852 0.328E+00 0.205E+01
DAV: 6 -0.597451204664E+02 0.51746E+01 -0.17782E+01 816 0.232E+01 0.107E+01
DAV: 7 -0.594806384677E+02 0.26448E+00 -0.13106E+00 883 0.636E+00 0.424E+00
DAV: 8 -0.594593122487E+02 0.21326E-01 -0.18761E-01 864 0.273E+00 0.122E+00
DAV: 9 -0.594640784900E+02 -0.47662E-02 -0.24755E-02 923 0.145E+00 0.350E-01
DAV: 10 -0.594661686252E+02 -0.20901E-02 -0.58925E-03 864 0.473E-01 0.176E-01
DAV: 11 -0.594676739805E+02 -0.15054E-02 -0.13200E-03 773 0.274E-01 0.646E-02
DAV: 12 -0.594689899011E+02 -0.13159E-02 -0.25061E-04 844 0.134E-01 0.289E-02
DAV: 13 -0.594703784413E+02 -0.13885E-02 -0.19250E-04 780 0.105E-01 0.218E-02
DAV: 14 -0.594712006169E+02 -0.82218E-03 -0.10932E-04 780 0.673E-02 0.125E-02
DAV: 15 -0.594716967343E+02 -0.49612E-03 -0.46623E-05 777 0.408E-02 0.677E-03
DAV: 16 -0.594718760688E+02 -0.17933E-03 -0.13606E-05 588 0.216E-02 0.452E-03
DAV: 17 -0.594720404594E+02 -0.16439E-03 -0.12405E-05 581 0.174E-02 0.266E-03
DAV: 18 -0.594720995704E+02 -0.59111E-04 -0.37033E-06 609 0.802E-03 0.164E-03
DAV: 19 -0.594721397239E+02 -0.40154E-04 -0.30140E-06 528 0.802E-03 0.110E-03
DAV: 20 -0.594721450130E+02 -0.52891E-05 -0.57751E-07 480 0.312E-03
1 F= -.59472145E+02 E0= -.59476013E+02 d E =0.116028E-01