./iterations/neb0_image06_iter88_OSZICAR.out output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.375596133840E+03 0.37560E+03 -0.14310E+04 632 0.799E+02
DAV: 2 0.364236257637E+01 -0.37195E+03 -0.35973E+03 877 0.195E+02
DAV: 3 -0.955584055711E+02 -0.99201E+02 -0.98878E+02 648 0.117E+02
DAV: 4 -0.100182210837E+03 -0.46238E+01 -0.46128E+01 704 0.293E+01
DAV: 5 -0.100276848579E+03 -0.94638E-01 -0.94598E-01 744 0.374E+00 0.226E+01
DAV: 6 -0.916370228589E+02 0.86398E+01 -0.30940E+01 706 0.307E+01 0.118E+01
DAV: 7 -0.908068520310E+02 0.83017E+00 -0.17265E+00 720 0.629E+00 0.481E+00
DAV: 8 -0.904260181110E+02 0.38083E+00 -0.52129E-01 712 0.401E+00 0.168E+00
DAV: 9 -0.903335321467E+02 0.92486E-01 -0.13321E-01 720 0.162E+00 0.422E-01
DAV: 10 -0.903237909627E+02 0.97412E-02 -0.43690E-02 728 0.107E+00 0.303E-01
DAV: 11 -0.903283750356E+02 -0.45841E-02 -0.12571E-02 615 0.639E-01 0.164E-01
DAV: 12 -0.903302333320E+02 -0.18583E-02 -0.22611E-03 656 0.254E-01 0.119E-01
DAV: 13 -0.903349057157E+02 -0.46724E-02 -0.31965E-03 662 0.372E-01 0.679E-02
DAV: 14 -0.903365518008E+02 -0.16461E-02 -0.50402E-04 712 0.149E-01 0.505E-02
DAV: 15 -0.903394397378E+02 -0.28879E-02 -0.72631E-04 631 0.146E-01 0.385E-02
DAV: 16 -0.903408660190E+02 -0.14263E-02 -0.20681E-04 693 0.732E-02 0.285E-02
DAV: 17 -0.903415447010E+02 -0.67868E-03 -0.14966E-04 802 0.841E-02 0.136E-02
DAV: 18 -0.903420633214E+02 -0.51862E-03 -0.78337E-05 647 0.512E-02 0.100E-02
DAV: 19 -0.903422950907E+02 -0.23177E-03 -0.18284E-05 490 0.204E-02 0.894E-03
DAV: 20 -0.903423851956E+02 -0.90105E-04 -0.15902E-05 504 0.239E-02 0.436E-03
DAV: 21 -0.903424392434E+02 -0.54048E-04 -0.76088E-06 444 0.129E-02 0.394E-03
DAV: 22 -0.903424533802E+02 -0.14137E-04 -0.21404E-06 477 0.790E-03 0.256E-03
DAV: 23 -0.903424614639E+02 -0.80837E-05 -0.42486E-06 397 0.127E-02
1 F= -.90342461E+02 E0= -.90347929E+02 d E =0.164035E-01