./iterations/neb0_image07_iter270_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 0.371326062633E+03 0.37133E+03 -0.14321E+04 632 0.799E+02
DAV: 2 0.363976467012E+01 -0.36769E+03 -0.35640E+03 863 0.194E+02
DAV: 3 -0.963650296760E+02 -0.10000E+03 -0.99693E+02 664 0.116E+02
DAV: 4 -0.101165824705E+03 -0.48008E+01 -0.47888E+01 712 0.296E+01
DAV: 5 -0.101261566533E+03 -0.95742E-01 -0.95698E-01 728 0.378E+00 0.227E+01
DAV: 6 -0.926228822997E+02 0.86387E+01 -0.30944E+01 701 0.299E+01 0.119E+01
DAV: 7 -0.917639690659E+02 0.85891E+00 -0.17040E+00 736 0.612E+00 0.480E+00
DAV: 8 -0.913885863482E+02 0.37538E+00 -0.54664E-01 736 0.399E+00 0.162E+00
DAV: 9 -0.913062660334E+02 0.82320E-01 -0.12757E-01 720 0.152E+00 0.422E-01
DAV: 10 -0.912971578692E+02 0.91082E-02 -0.43616E-02 725 0.105E+00 0.297E-01
DAV: 11 -0.913020451702E+02 -0.48873E-02 -0.13225E-02 613 0.586E-01 0.154E-01
DAV: 12 -0.913051499585E+02 -0.31048E-02 -0.28886E-03 615 0.238E-01 0.105E-01
DAV: 13 -0.913088877066E+02 -0.37377E-02 -0.19577E-03 665 0.231E-01 0.481E-02
DAV: 14 -0.913122742007E+02 -0.33865E-02 -0.78387E-04 653 0.175E-01 0.311E-02
DAV: 15 -0.913135802962E+02 -0.13061E-02 -0.19824E-04 680 0.809E-02 0.259E-02
DAV: 16 -0.913145377030E+02 -0.95741E-03 -0.24517E-04 701 0.101E-01 0.182E-02
DAV: 17 -0.913151180041E+02 -0.58030E-03 -0.59086E-05 655 0.443E-02 0.139E-02
DAV: 18 -0.913152886431E+02 -0.17064E-03 -0.25983E-05 552 0.270E-02 0.847E-03
DAV: 19 -0.913154640067E+02 -0.17536E-03 -0.25046E-05 494 0.240E-02 0.238E-03
DAV: 20 -0.913154927376E+02 -0.28731E-04 -0.29202E-06 512 0.843E-03 0.218E-03
DAV: 21 -0.913155186974E+02 -0.25960E-04 -0.35648E-06 403 0.110E-02 0.127E-03
DAV: 22 -0.913155232783E+02 -0.45810E-05 -0.92396E-07 496 0.459E-03
1 F= -.91315523E+02 E0= -.91320174E+02 d E =0.139524E-01