./iterations/neb0_image08_iter111_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 0.376224738468E+03 0.37622E+03 -0.14285E+04 624 0.799E+02
DAV: 2 0.349571622664E+01 -0.37273E+03 -0.35971E+03 869 0.196E+02
DAV: 3 -0.967946102957E+02 -0.10029E+03 -0.99951E+02 680 0.117E+02
DAV: 4 -0.101202836042E+03 -0.44082E+01 -0.43980E+01 696 0.279E+01
DAV: 5 -0.101289749859E+03 -0.86914E-01 -0.86879E-01 736 0.352E+00 0.228E+01
DAV: 6 -0.926211492112E+02 0.86686E+01 -0.30796E+01 714 0.302E+01 0.119E+01
DAV: 7 -0.917447280112E+02 0.87642E+00 -0.17171E+00 720 0.616E+00 0.481E+00
DAV: 8 -0.913654164230E+02 0.37931E+00 -0.55285E-01 712 0.401E+00 0.163E+00
DAV: 9 -0.912824361432E+02 0.82980E-01 -0.13175E-01 712 0.156E+00 0.425E-01
DAV: 10 -0.912734615981E+02 0.89745E-02 -0.47142E-02 744 0.114E+00 0.308E-01
DAV: 11 -0.912781182937E+02 -0.46567E-02 -0.14066E-02 624 0.617E-01 0.153E-01
DAV: 12 -0.912809949311E+02 -0.28766E-02 -0.30445E-03 609 0.249E-01 0.120E-01
DAV: 13 -0.912846558852E+02 -0.36610E-02 -0.16607E-03 725 0.227E-01 0.452E-02
DAV: 14 -0.912879276754E+02 -0.32718E-02 -0.59725E-04 656 0.136E-01 0.362E-02
DAV: 15 -0.912896166204E+02 -0.16889E-02 -0.18803E-04 656 0.809E-02 0.401E-02
DAV: 16 -0.912908918074E+02 -0.12752E-02 -0.37938E-04 650 0.998E-02 0.200E-02
DAV: 17 -0.912912077814E+02 -0.31597E-03 -0.62552E-05 696 0.576E-02 0.140E-02
DAV: 18 -0.912914727842E+02 -0.26500E-03 -0.48126E-05 631 0.322E-02 0.129E-02
DAV: 19 -0.912915577929E+02 -0.85009E-04 -0.10448E-05 480 0.194E-02 0.603E-03
DAV: 20 -0.912915925247E+02 -0.34732E-04 -0.13924E-05 448 0.234E-02 0.265E-03
DAV: 21 -0.912916119952E+02 -0.19470E-04 -0.35425E-06 442 0.931E-03 0.308E-03
DAV: 22 -0.912916184459E+02 -0.64507E-05 -0.92165E-07 448 0.541E-03
1 F= -.91291618E+02 E0= -.91296683E+02 d E =0.151923E-01