./iterations/neb0_image02_iter234_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 0.365796109767E+03 0.36580E+03 -0.14293E+04 624 0.799E+02
DAV: 2 0.302595181126E+00 -0.36549E+03 -0.35499E+03 877 0.195E+02
DAV: 3 -0.956529377786E+02 -0.95956E+02 -0.95626E+02 629 0.115E+02
DAV: 4 -0.100210070197E+03 -0.45571E+01 -0.45463E+01 712 0.294E+01
DAV: 5 -0.100300904484E+03 -0.90834E-01 -0.90805E-01 744 0.373E+00 0.221E+01
DAV: 6 -0.916634558466E+02 0.86374E+01 -0.31034E+01 680 0.299E+01 0.117E+01
DAV: 7 -0.908536135791E+02 0.80984E+00 -0.18161E+00 720 0.637E+00 0.484E+00
DAV: 8 -0.904731816505E+02 0.38043E+00 -0.55584E-01 696 0.432E+00 0.170E+00
DAV: 9 -0.903874699780E+02 0.85712E-01 -0.13570E-01 720 0.167E+00 0.429E-01
DAV: 10 -0.903826160525E+02 0.48539E-02 -0.48535E-02 704 0.124E+00 0.329E-01
DAV: 11 -0.903862992056E+02 -0.36832E-02 -0.76333E-03 632 0.595E-01 0.118E-01
DAV: 12 -0.903892928248E+02 -0.29936E-02 -0.64266E-03 632 0.405E-01 0.133E-01
DAV: 13 -0.903920132016E+02 -0.27204E-02 -0.18796E-03 861 0.333E-01 0.821E-02
DAV: 14 -0.903951124491E+02 -0.30992E-02 -0.12823E-03 621 0.166E-01 0.690E-02
DAV: 15 -0.903969419657E+02 -0.18295E-02 -0.32808E-04 693 0.107E-01 0.500E-02
DAV: 16 -0.903983755175E+02 -0.14336E-02 -0.98761E-04 672 0.182E-01 0.406E-02
DAV: 17 -0.903989658289E+02 -0.59031E-03 -0.14309E-04 768 0.834E-02 0.249E-02
DAV: 18 -0.903992627096E+02 -0.29688E-03 -0.82723E-05 672 0.454E-02 0.755E-03
DAV: 19 -0.903994579371E+02 -0.19523E-03 -0.34933E-05 585 0.290E-02 0.691E-03
DAV: 20 -0.903994941787E+02 -0.36242E-04 -0.33604E-06 504 0.126E-02 0.555E-03
DAV: 21 -0.903995494930E+02 -0.55314E-04 -0.14103E-05 425 0.203E-02 0.306E-03
DAV: 22 -0.903995552251E+02 -0.57322E-05 -0.31339E-06 496 0.104E-02
1 F= -.90399555E+02 E0= -.90406588E+02 d E =0.210979E-01