./iterations/neb0_image08_iter135_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 0.374753174845E+03 0.37475E+03 -0.14279E+04 624 0.799E+02
DAV: 2 0.409326903006E+01 -0.37066E+03 -0.35726E+03 861 0.196E+02
DAV: 3 -0.966484214216E+02 -0.10074E+03 -0.10041E+03 677 0.117E+02
DAV: 4 -0.101158690104E+03 -0.45103E+01 -0.44990E+01 712 0.281E+01
DAV: 5 -0.101247987903E+03 -0.89298E-01 -0.89260E-01 736 0.356E+00 0.227E+01
DAV: 6 -0.926239389692E+02 0.86240E+01 -0.30788E+01 714 0.300E+01 0.119E+01
DAV: 7 -0.917640414262E+02 0.85990E+00 -0.17107E+00 728 0.615E+00 0.480E+00
DAV: 8 -0.913871930267E+02 0.37685E+00 -0.55809E-01 696 0.403E+00 0.161E+00
DAV: 9 -0.913067166303E+02 0.80476E-01 -0.12995E-01 720 0.156E+00 0.422E-01
DAV: 10 -0.912981206147E+02 0.85960E-02 -0.45128E-02 744 0.111E+00 0.302E-01
DAV: 11 -0.913025914513E+02 -0.44708E-02 -0.12104E-02 605 0.571E-01 0.137E-01
DAV: 12 -0.913057972360E+02 -0.32058E-02 -0.29697E-03 620 0.258E-01 0.112E-01
DAV: 13 -0.913091345311E+02 -0.33373E-02 -0.10456E-03 704 0.185E-01 0.494E-02
DAV: 14 -0.913123384325E+02 -0.32039E-02 -0.89370E-04 645 0.160E-01 0.427E-02
DAV: 15 -0.913139655878E+02 -0.16272E-02 -0.21667E-04 736 0.985E-02 0.425E-02
DAV: 16 -0.913152538165E+02 -0.12882E-02 -0.41530E-04 640 0.100E-01 0.195E-02
DAV: 17 -0.913156822153E+02 -0.42840E-03 -0.75112E-05 744 0.573E-02 0.142E-02
DAV: 18 -0.913159586975E+02 -0.27648E-03 -0.52488E-05 618 0.326E-02 0.107E-02
DAV: 19 -0.913160042907E+02 -0.45593E-04 -0.66271E-06 496 0.169E-02 0.516E-03
DAV: 20 -0.913160368504E+02 -0.32560E-04 -0.10877E-05 418 0.204E-02 0.278E-03
DAV: 21 -0.913160492145E+02 -0.12364E-04 -0.22889E-06 488 0.785E-03 0.270E-03
DAV: 22 -0.913160589311E+02 -0.97166E-05 -0.13532E-06 398 0.701E-03
1 F= -.91316059E+02 E0= -.91321101E+02 d E =0.151258E-01