./iterations/neb0_image09_iter288_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 0.374313186244E+03 0.37431E+03 -0.14283E+04 624 0.799E+02
DAV: 2 0.334244108890E+01 -0.37097E+03 -0.35831E+03 866 0.196E+02
DAV: 3 -0.967625146218E+02 -0.10010E+03 -0.99782E+02 664 0.117E+02
DAV: 4 -0.101291155043E+03 -0.45286E+01 -0.45179E+01 712 0.287E+01
DAV: 5 -0.101380357328E+03 -0.89202E-01 -0.89163E-01 728 0.365E+00 0.227E+01
DAV: 6 -0.926837854314E+02 0.86966E+01 -0.31006E+01 725 0.300E+01 0.119E+01
DAV: 7 -0.918115430076E+02 0.87224E+00 -0.17188E+00 720 0.613E+00 0.480E+00
DAV: 8 -0.914358036654E+02 0.37574E+00 -0.54301E-01 704 0.396E+00 0.162E+00
DAV: 9 -0.913546718827E+02 0.81132E-01 -0.13186E-01 728 0.154E+00 0.421E-01
DAV: 10 -0.913464874271E+02 0.81845E-02 -0.45055E-02 760 0.108E+00 0.304E-01
DAV: 11 -0.913511845663E+02 -0.46971E-02 -0.13493E-02 608 0.603E-01 0.145E-01
DAV: 12 -0.913541382176E+02 -0.29537E-02 -0.28299E-03 629 0.225E-01 0.114E-01
DAV: 13 -0.913580012858E+02 -0.38631E-02 -0.24650E-03 693 0.260E-01 0.518E-02
DAV: 14 -0.913612655317E+02 -0.32642E-02 -0.60926E-04 672 0.131E-01 0.243E-02
DAV: 15 -0.913627191997E+02 -0.14537E-02 -0.12080E-04 688 0.557E-02 0.191E-02
DAV: 16 -0.913638751588E+02 -0.11560E-02 -0.18398E-04 653 0.635E-02 0.141E-02
DAV: 17 -0.913640622761E+02 -0.18712E-03 -0.13430E-05 496 0.298E-02 0.108E-02
DAV: 18 -0.913643065695E+02 -0.24429E-03 -0.72676E-05 612 0.449E-02 0.108E-02
DAV: 19 -0.913643367088E+02 -0.30139E-04 -0.87331E-06 512 0.268E-02 0.486E-03
DAV: 20 -0.913643635261E+02 -0.26817E-04 -0.13792E-05 418 0.210E-02 0.283E-03
DAV: 21 -0.913643854522E+02 -0.21926E-04 -0.44132E-06 448 0.947E-03 0.373E-03
DAV: 22 -0.913643881106E+02 -0.26584E-05 -0.62203E-07 512 0.667E-03
1 F= -.91364388E+02 E0= -.91369068E+02 d E =0.140402E-01