./iterations/neb0_image05_iter210_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 0.366720311194E+03 0.36672E+03 -0.14288E+04 624 0.799E+02
DAV: 2 0.340711638794E+01 -0.36331E+03 -0.35011E+03 856 0.195E+02
DAV: 3 -0.953813099374E+02 -0.98788E+02 -0.98458E+02 677 0.116E+02
DAV: 4 -0.998455101660E+02 -0.44642E+01 -0.44537E+01 704 0.280E+01
DAV: 5 -0.999346709488E+02 -0.89161E-01 -0.89116E-01 728 0.352E+00 0.220E+01
DAV: 6 -0.914969816011E+02 0.84377E+01 -0.30548E+01 704 0.297E+01 0.116E+01
DAV: 7 -0.907016279550E+02 0.79535E+00 -0.17400E+00 720 0.634E+00 0.481E+00
DAV: 8 -0.903301386524E+02 0.37149E+00 -0.53692E-01 720 0.429E+00 0.166E+00
DAV: 9 -0.902462916838E+02 0.83847E-01 -0.13474E-01 720 0.168E+00 0.440E-01
DAV: 10 -0.902394864716E+02 0.68052E-02 -0.38241E-02 704 0.117E+00 0.302E-01
DAV: 11 -0.902423773761E+02 -0.28909E-02 -0.58661E-03 616 0.525E-01 0.146E-01
DAV: 12 -0.902446830064E+02 -0.23056E-02 -0.48718E-03 624 0.429E-01 0.104E-01
DAV: 13 -0.902479014801E+02 -0.32185E-02 -0.11040E-03 722 0.231E-01 0.769E-02
DAV: 14 -0.902512450349E+02 -0.33436E-02 -0.11088E-03 636 0.146E-01 0.444E-02
DAV: 15 -0.902541271738E+02 -0.28821E-02 -0.55469E-04 728 0.147E-01 0.333E-02
DAV: 16 -0.902552177157E+02 -0.10905E-02 -0.26806E-04 688 0.832E-02 0.282E-02
DAV: 17 -0.902558437704E+02 -0.62605E-03 -0.15209E-04 784 0.836E-02 0.149E-02
DAV: 18 -0.902561081037E+02 -0.26433E-03 -0.77436E-05 650 0.514E-02 0.151E-02
DAV: 19 -0.902563275425E+02 -0.21944E-03 -0.28772E-05 552 0.292E-02 0.103E-02
DAV: 20 -0.902563752740E+02 -0.47731E-04 -0.23421E-05 632 0.302E-02 0.356E-03
DAV: 21 -0.902564221557E+02 -0.46882E-04 -0.69886E-06 415 0.159E-02 0.305E-03
DAV: 22 -0.902564362309E+02 -0.14075E-04 -0.22760E-06 488 0.709E-03 0.210E-03
DAV: 23 -0.902564397729E+02 -0.35420E-05 -0.11424E-06 448 0.689E-03
1 F= -.90256440E+02 E0= -.90265347E+02 d E =0.267218E-01