./iterations/neb0_image03_iter269_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 0.363797064568E+03 0.36380E+03 -0.14329E+04 632 0.799E+02
DAV: 2 0.178575449844E+01 -0.36201E+03 -0.34976E+03 845 0.195E+02
DAV: 3 -0.960588843963E+02 -0.97845E+02 -0.97533E+02 677 0.116E+02
DAV: 4 -0.100346969483E+03 -0.42881E+01 -0.42777E+01 704 0.275E+01
DAV: 5 -0.100430092794E+03 -0.83123E-01 -0.83097E-01 744 0.344E+00 0.223E+01
DAV: 6 -0.917178445476E+02 0.87122E+01 -0.31469E+01 688 0.300E+01 0.117E+01
DAV: 7 -0.908766224608E+02 0.84122E+00 -0.18067E+00 712 0.632E+00 0.484E+00
DAV: 8 -0.904862245550E+02 0.39040E+00 -0.55249E-01 696 0.426E+00 0.170E+00
DAV: 9 -0.903949999672E+02 0.91225E-01 -0.13535E-01 704 0.168E+00 0.437E-01
DAV: 10 -0.903889719733E+02 0.60280E-02 -0.47831E-02 712 0.122E+00 0.335E-01
DAV: 11 -0.903930595255E+02 -0.40876E-02 -0.75713E-03 624 0.617E-01 0.120E-01
DAV: 12 -0.903964030969E+02 -0.33436E-02 -0.56031E-03 629 0.355E-01 0.120E-01
DAV: 13 -0.904004522632E+02 -0.40492E-02 -0.14665E-03 818 0.274E-01 0.846E-02
DAV: 14 -0.904036745458E+02 -0.32223E-02 -0.12094E-03 653 0.154E-01 0.548E-02
DAV: 15 -0.904058364655E+02 -0.21619E-02 -0.32713E-04 680 0.958E-02 0.284E-02
DAV: 16 -0.904072898328E+02 -0.14534E-02 -0.37208E-04 658 0.102E-01 0.273E-02
DAV: 17 -0.904078655943E+02 -0.57576E-03 -0.11214E-04 784 0.683E-02 0.117E-02
DAV: 18 -0.904081185673E+02 -0.25297E-03 -0.56915E-05 664 0.396E-02 0.119E-02
DAV: 19 -0.904082400329E+02 -0.12147E-03 -0.12648E-05 477 0.242E-02 0.635E-03
DAV: 20 -0.904083097992E+02 -0.69766E-04 -0.29711E-05 592 0.294E-02 0.659E-03
DAV: 21 -0.904083462594E+02 -0.36460E-04 -0.71922E-06 445 0.223E-02 0.196E-03
DAV: 22 -0.904083557623E+02 -0.95029E-05 -0.59546E-06 504 0.124E-02
1 F= -.90408356E+02 E0= -.90416344E+02 d E =0.239642E-01