./iterations/neb0_image03_iter257_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 0.363295692236E+03 0.36330E+03 -0.14325E+04 632 0.799E+02
DAV: 2 0.538308605064E+00 -0.36276E+03 -0.35228E+03 853 0.195E+02
DAV: 3 -0.961331563357E+02 -0.96671E+02 -0.96374E+02 669 0.115E+02
DAV: 4 -0.100325061303E+03 -0.41919E+01 -0.41824E+01 712 0.275E+01
DAV: 5 -0.100406571205E+03 -0.81510E-01 -0.81484E-01 744 0.345E+00 0.223E+01
DAV: 6 -0.917219312789E+02 0.86846E+01 -0.31385E+01 680 0.300E+01 0.117E+01
DAV: 7 -0.908831087973E+02 0.83882E+00 -0.17989E+00 720 0.634E+00 0.485E+00
DAV: 8 -0.904907266031E+02 0.39238E+00 -0.55591E-01 696 0.428E+00 0.170E+00
DAV: 9 -0.903989870542E+02 0.91740E-01 -0.13414E-01 704 0.168E+00 0.437E-01
DAV: 10 -0.903927557613E+02 0.62313E-02 -0.48948E-02 712 0.122E+00 0.338E-01
DAV: 11 -0.903971564584E+02 -0.44007E-02 -0.85744E-03 680 0.650E-01 0.117E-01
DAV: 12 -0.904003167141E+02 -0.31603E-02 -0.52506E-03 632 0.334E-01 0.123E-01
DAV: 13 -0.904044287839E+02 -0.41121E-02 -0.16941E-03 837 0.299E-01 0.865E-02
DAV: 14 -0.904075618278E+02 -0.31330E-02 -0.11421E-03 661 0.150E-01 0.567E-02
DAV: 15 -0.904097725337E+02 -0.22107E-02 -0.37663E-04 664 0.102E-01 0.296E-02
DAV: 16 -0.904111403128E+02 -0.13678E-02 -0.34278E-04 661 0.956E-02 0.250E-02
DAV: 17 -0.904118785497E+02 -0.73824E-03 -0.13098E-04 722 0.675E-02 0.103E-02
DAV: 18 -0.904121103300E+02 -0.23178E-03 -0.52555E-05 672 0.361E-02 0.114E-02
DAV: 19 -0.904121767389E+02 -0.66409E-04 -0.82091E-06 488 0.210E-02 0.512E-03
DAV: 20 -0.904122511878E+02 -0.74449E-04 -0.25853E-05 565 0.268E-02 0.659E-03
DAV: 21 -0.904122752981E+02 -0.24110E-04 -0.51361E-06 488 0.181E-02 0.195E-03
DAV: 22 -0.904122814549E+02 -0.61568E-05 -0.35863E-06 520 0.939E-03
1 F= -.90412281E+02 E0= -.90419958E+02 d E =0.230288E-01