./iterations/neb0_image02_iter293_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 0.366200226691E+03 0.36620E+03 -0.14302E+04 624 0.799E+02
DAV: 2 0.110121422158E+01 -0.36510E+03 -0.35341E+03 869 0.196E+02
DAV: 3 -0.956124214283E+02 -0.96714E+02 -0.96382E+02 632 0.115E+02
DAV: 4 -0.100286956930E+03 -0.46745E+01 -0.46638E+01 704 0.296E+01
DAV: 5 -0.100379374382E+03 -0.92417E-01 -0.92380E-01 720 0.375E+00 0.223E+01
DAV: 6 -0.916807129207E+02 0.86987E+01 -0.30908E+01 680 0.299E+01 0.118E+01
DAV: 7 -0.908478968325E+02 0.83282E+00 -0.18156E+00 712 0.634E+00 0.485E+00
DAV: 8 -0.904681689426E+02 0.37973E+00 -0.55210E-01 704 0.429E+00 0.169E+00
DAV: 9 -0.903851864641E+02 0.82982E-01 -0.13434E-01 720 0.167E+00 0.425E-01
DAV: 10 -0.903812943656E+02 0.38921E-02 -0.48232E-02 720 0.126E+00 0.326E-01
DAV: 11 -0.903851656045E+02 -0.38712E-02 -0.81089E-03 621 0.589E-01 0.117E-01
DAV: 12 -0.903883625764E+02 -0.31970E-02 -0.66484E-03 632 0.427E-01 0.137E-01
DAV: 13 -0.903906773654E+02 -0.23148E-02 -0.19703E-03 872 0.332E-01 0.774E-02
DAV: 14 -0.903938127539E+02 -0.31354E-02 -0.13751E-03 615 0.185E-01 0.717E-02
DAV: 15 -0.903953458903E+02 -0.15331E-02 -0.25217E-04 688 0.982E-02 0.568E-02
DAV: 16 -0.903967442822E+02 -0.13984E-02 -0.10248E-03 648 0.195E-01 0.349E-02
DAV: 17 -0.903974021321E+02 -0.65785E-03 -0.11210E-04 688 0.692E-02 0.324E-02
DAV: 18 -0.903977499111E+02 -0.34778E-03 -0.92124E-05 650 0.491E-02 0.162E-02
DAV: 19 -0.903979042734E+02 -0.15436E-03 -0.70902E-05 664 0.451E-02 0.849E-03
DAV: 20 -0.903979387915E+02 -0.34518E-04 -0.48508E-06 488 0.146E-02 0.747E-03
DAV: 21 -0.903979778435E+02 -0.39052E-04 -0.10318E-05 418 0.185E-02 0.331E-03
DAV: 22 -0.903979825942E+02 -0.47506E-05 -0.47179E-06 504 0.133E-02
1 F= -.90397983E+02 E0= -.90403460E+02 d E =0.164311E-01