./iterations/neb0_image08_iter15_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 0.370000291561E+03 0.37000E+03 -0.14255E+04 624 0.799E+02
DAV: 2 0.231735010787E+01 -0.36768E+03 -0.35538E+03 877 0.195E+02
DAV: 3 -0.962185741079E+02 -0.98536E+02 -0.98202E+02 680 0.116E+02
DAV: 4 -0.100558496211E+03 -0.43399E+01 -0.43276E+01 704 0.276E+01
DAV: 5 -0.100645612375E+03 -0.87116E-01 -0.87065E-01 744 0.352E+00 0.222E+01
DAV: 6 -0.920967125698E+02 0.85489E+01 -0.30774E+01 704 0.300E+01 0.116E+01
DAV: 7 -0.912749398524E+02 0.82177E+00 -0.17175E+00 712 0.638E+00 0.475E+00
DAV: 8 -0.909082686010E+02 0.36667E+00 -0.57991E-01 712 0.416E+00 0.166E+00
DAV: 9 -0.908261606760E+02 0.82108E-01 -0.12775E-01 717 0.160E+00 0.443E-01
DAV: 10 -0.908171110297E+02 0.90496E-02 -0.31223E-02 736 0.867E-01 0.274E-01
DAV: 11 -0.908216388049E+02 -0.45278E-02 -0.12282E-02 602 0.659E-01 0.181E-01
DAV: 12 -0.908227194791E+02 -0.10807E-02 -0.21606E-03 712 0.288E-01 0.115E-01
DAV: 13 -0.908276983726E+02 -0.49789E-02 -0.52908E-03 691 0.470E-01 0.103E-01
DAV: 14 -0.908286739702E+02 -0.97560E-03 -0.83396E-04 768 0.226E-01 0.667E-02
DAV: 15 -0.908307513765E+02 -0.20774E-02 -0.12840E-03 688 0.222E-01 0.365E-02
DAV: 16 -0.908327322329E+02 -0.19809E-02 -0.28988E-04 682 0.110E-01 0.267E-02
DAV: 17 -0.908338604248E+02 -0.11282E-02 -0.12988E-04 677 0.551E-02 0.886E-03
DAV: 18 -0.908344477001E+02 -0.58728E-03 -0.75548E-05 578 0.380E-02 0.105E-02
DAV: 19 -0.908345731203E+02 -0.12542E-03 -0.10191E-05 504 0.236E-02 0.579E-03
DAV: 20 -0.908346650177E+02 -0.91897E-04 -0.22488E-05 489 0.216E-02 0.575E-03
DAV: 21 -0.908346754499E+02 -0.10432E-04 -0.30773E-06 520 0.148E-02 0.329E-03
DAV: 22 -0.908347001876E+02 -0.24738E-04 -0.53905E-06 392 0.129E-02 0.244E-03
DAV: 23 -0.908347065647E+02 -0.63771E-05 -0.17916E-06 474 0.748E-03
1 F= -.90834707E+02 E0= -.90839019E+02 d E =0.129372E-01