./iterations/neb0_image01_iter192_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 0.365707983409E+03 0.36571E+03 -0.14299E+04 624 0.799E+02
DAV: 2 0.321147878891E+01 -0.36250E+03 -0.34953E+03 839 0.196E+02
DAV: 3 -0.955955441903E+02 -0.98807E+02 -0.98459E+02 669 0.116E+02
DAV: 4 -0.100229247007E+03 -0.46337E+01 -0.46227E+01 688 0.287E+01
DAV: 5 -0.100322422722E+03 -0.93176E-01 -0.93125E-01 736 0.363E+00 0.222E+01
DAV: 6 -0.916902402677E+02 0.86322E+01 -0.30973E+01 688 0.299E+01 0.117E+01
DAV: 7 -0.908845340036E+02 0.80571E+00 -0.18278E+00 712 0.638E+00 0.484E+00
DAV: 8 -0.905089527352E+02 0.37558E+00 -0.55376E-01 704 0.429E+00 0.167E+00
DAV: 9 -0.904268370055E+02 0.82116E-01 -0.13248E-01 720 0.167E+00 0.423E-01
DAV: 10 -0.904222765249E+02 0.45605E-02 -0.46957E-02 720 0.124E+00 0.322E-01
DAV: 11 -0.904264085257E+02 -0.41320E-02 -0.78978E-03 608 0.571E-01 0.120E-01
DAV: 12 -0.904297582948E+02 -0.33498E-02 -0.64114E-03 634 0.444E-01 0.131E-01
DAV: 13 -0.904321836726E+02 -0.24254E-02 -0.16212E-03 861 0.308E-01 0.746E-02
DAV: 14 -0.904353817539E+02 -0.31981E-02 -0.14668E-03 634 0.193E-01 0.688E-02
DAV: 15 -0.904369531121E+02 -0.15714E-02 -0.29230E-04 696 0.112E-01 0.547E-02
DAV: 16 -0.904383466912E+02 -0.13936E-02 -0.11167E-03 661 0.206E-01 0.395E-02
DAV: 17 -0.904391478333E+02 -0.80114E-03 -0.14556E-04 664 0.833E-02 0.340E-02
DAV: 18 -0.904394602141E+02 -0.31238E-03 -0.80879E-05 680 0.448E-02 0.193E-02
DAV: 19 -0.904396478843E+02 -0.18767E-03 -0.10064E-04 634 0.567E-02 0.950E-03
DAV: 20 -0.904396762644E+02 -0.28380E-04 -0.10210E-05 512 0.214E-02 0.101E-02
DAV: 21 -0.904397133529E+02 -0.37088E-04 -0.74398E-06 404 0.154E-02 0.753E-03
DAV: 22 -0.904397263168E+02 -0.12964E-04 -0.53878E-06 480 0.188E-02 0.314E-03
DAV: 23 -0.904397297974E+02 -0.34806E-05 -0.71223E-06 496 0.152E-02
1 F= -.90439730E+02 E0= -.90445271E+02 d E =0.166234E-01