./iterations/neb0_image05_iter294_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 0.367377094422E+03 0.36738E+03 -0.14306E+04 624 0.799E+02
DAV: 2 0.469405488293E+01 -0.36268E+03 -0.34898E+03 840 0.196E+02
DAV: 3 -0.952081135274E+02 -0.99902E+02 -0.99558E+02 648 0.117E+02
DAV: 4 -0.100078797787E+03 -0.48707E+01 -0.48585E+01 712 0.300E+01
DAV: 5 -0.100176758058E+03 -0.97960E-01 -0.97917E-01 733 0.381E+00 0.222E+01
DAV: 6 -0.915638132084E+02 0.86129E+01 -0.31058E+01 688 0.302E+01 0.117E+01
DAV: 7 -0.907486779686E+02 0.81514E+00 -0.17605E+00 720 0.649E+00 0.483E+00
DAV: 8 -0.903701208617E+02 0.37856E+00 -0.51535E-01 720 0.430E+00 0.178E+00
DAV: 9 -0.902834272016E+02 0.86694E-01 -0.13933E-01 728 0.195E+00 0.546E-01
DAV: 10 -0.902721981343E+02 0.11229E-01 -0.24560E-02 736 0.889E-01 0.326E-01
DAV: 11 -0.902732701240E+02 -0.10720E-02 -0.16099E-02 704 0.685E-01 0.211E-01
DAV: 12 -0.902765725753E+02 -0.33025E-02 -0.57612E-03 720 0.462E-01 0.117E-01
DAV: 13 -0.902791061643E+02 -0.25336E-02 -0.14077E-03 628 0.209E-01 0.104E-01
DAV: 14 -0.902829687305E+02 -0.38626E-02 -0.21547E-03 721 0.287E-01 0.536E-02
DAV: 15 -0.902854960332E+02 -0.25273E-02 -0.47377E-04 664 0.119E-01 0.424E-02
DAV: 16 -0.902882760055E+02 -0.27800E-02 -0.72738E-04 666 0.156E-01 0.275E-02
DAV: 17 -0.902891087664E+02 -0.83276E-03 -0.11979E-04 728 0.628E-02 0.227E-02
DAV: 18 -0.902897124544E+02 -0.60369E-03 -0.13332E-04 676 0.664E-02 0.929E-03
DAV: 19 -0.902899783439E+02 -0.26589E-03 -0.44561E-05 680 0.333E-02 0.912E-03
DAV: 20 -0.902900697865E+02 -0.91443E-04 -0.81872E-06 466 0.137E-02 0.603E-03
DAV: 21 -0.902901073170E+02 -0.37531E-04 -0.15438E-05 538 0.235E-02 0.320E-03
DAV: 22 -0.902901206212E+02 -0.13304E-04 -0.26998E-06 433 0.100E-02 0.268E-03
DAV: 23 -0.902901220584E+02 -0.14372E-05 -0.13141E-06 488 0.668E-03
1 F= -.90290122E+02 E0= -.90298536E+02 d E =0.252408E-01