./iterations/neb0_image04_iter44_OSZICAR.out output for 40: 572-->565: F2 + F3Si-NF-SiF3, to SiF4 + F3Si-NF2 (TSS)
Status: finishedN E dE d eps ncg rms rms(c) DAV: 1 0.789612984094E+03 0.78961E+03 -0.25886E+04 912 0.101E+03 DAV: 2 0.102516346450E+03 -0.68710E+03 -0.66864E+03 1104 0.279E+02 DAV: 3 -0.599401331008E+02 -0.16246E+03 -0.16164E+03 854 0.154E+02 DAV: 4 -0.647710735554E+02 -0.48309E+01 -0.48130E+01 840 0.287E+01 DAV: 5 -0.648514441226E+02 -0.80371E-01 -0.80170E-01 889 0.343E+00 0.203E+01 DAV: 6 -0.655818136495E+02 -0.73037E+00 -0.13519E+02 854 0.395E+01 0.204E+01 DAV: 7 -0.591984333219E+02 0.63834E+01 -0.14027E+01 992 0.149E+01 0.112E+01 DAV: 8 -0.606809778084E+02 -0.14825E+01 -0.36941E+01 904 0.173E+01 0.122E+01 DAV: 9 -0.588321134335E+02 0.18489E+01 -0.79994E+00 1088 0.106E+01 0.714E+00 DAV: 10 -0.600622097963E+02 -0.12301E+01 -0.21322E+01 832 0.558E+00 0.112E+01 DAV: 11 -0.587131148356E+02 0.13491E+01 -0.23103E+00 1024 0.682E+00 0.400E+00 DAV: 12 -0.588077328073E+02 -0.94618E-01 -0.19675E+00 920 0.220E+00 0.508E+00 DAV: 13 -0.587566355446E+02 0.51097E-01 -0.84787E-01 891 0.240E+00 0.159E+00 DAV: 14 -0.587857567191E+02 -0.29121E-01 -0.24317E-01 800 0.107E+00 0.231E+00 DAV: 15 -0.588337761749E+02 -0.48019E-01 -0.10214E+00 1006 0.109E+00 0.522E+00 DAV: 16 -0.587486564047E+02 0.85120E-01 -0.10719E+00 1056 0.133E+00 0.238E+00 DAV: 17 -0.587863112488E+02 -0.37655E-01 -0.32071E-01 794 0.622E-01 0.199E+00 DAV: 18 -0.587807158186E+02 0.55954E-02 -0.11438E-02 824 0.280E-01 0.129E+00 DAV: 19 -0.587891353636E+02 -0.84195E-02 -0.25529E-02 1067 0.424E-01 0.234E+00 DAV: 20 -0.587718804931E+02 0.17255E-01 -0.50080E-02 971 0.290E-01 0.714E-01 DAV: 21 -0.587820091300E+02 -0.10129E-01 -0.72374E-04 816 0.113E-01 0.546E-01 DAV: 22 -0.587849188047E+02 -0.29097E-02 -0.10084E-02 907 0.110E-01 0.343E-01 DAV: 23 -0.587896150500E+02 -0.46962E-02 -0.70932E-03 902 0.138E-01 0.905E-01 DAV: 24 -0.587878048106E+02 0.18102E-02 -0.26815E-04 904 0.870E-02 0.953E-01 DAV: 25 -0.587851384869E+02 0.26663E-02 -0.98634E-03 806 0.882E-02 0.213E-01 DAV: 26 -0.587879801677E+02 -0.28417E-02 -0.45785E-04 726 0.655E-02 0.671E-02 DAV: 27 -0.587887973506E+02 -0.81718E-03 -0.28066E-04 777 0.458E-02 0.808E-02 DAV: 28 -0.587889872505E+02 -0.18990E-03 -0.21721E-04 591 0.252E-02 0.344E-02 DAV: 29 -0.587890337284E+02 -0.46478E-04 -0.30547E-05 606 0.107E-02 0.793E-03 DAV: 30 -0.587890576753E+02 -0.23947E-04 -0.22945E-05 579 0.905E-03 0.399E-02 DAV: 31 -0.587890557350E+02 0.19403E-05 -0.19587E-05 497 0.623E-03 1 F= -.58789056E+02 E0= -.58805129E+02 d E =0.482210E-01