./iterations/neb0_image02_iter25_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 0.367600076483E+03 0.36760E+03 -0.14297E+04 624 0.799E+02
DAV: 2 0.432342088254E+01 -0.36328E+03 -0.34883E+03 839 0.195E+02
DAV: 3 -0.955482038849E+02 -0.99872E+02 -0.99534E+02 680 0.116E+02
DAV: 4 -0.100066881466E+03 -0.45187E+01 -0.45082E+01 712 0.282E+01
DAV: 5 -0.100152783834E+03 -0.85902E-01 -0.85859E-01 736 0.352E+00 0.222E+01
DAV: 6 -0.914631462636E+02 0.86896E+01 -0.31096E+01 712 0.301E+01 0.117E+01
DAV: 7 -0.906527977101E+02 0.81035E+00 -0.18609E+00 712 0.631E+00 0.482E+00
DAV: 8 -0.902677189410E+02 0.38508E+00 -0.54898E-01 688 0.428E+00 0.173E+00
DAV: 9 -0.901729998437E+02 0.94719E-01 -0.14724E-01 696 0.172E+00 0.439E-01
DAV: 10 -0.901659748748E+02 0.70250E-02 -0.42803E-02 720 0.120E+00 0.309E-01
DAV: 11 -0.901697589140E+02 -0.37840E-02 -0.65473E-03 608 0.458E-01 0.141E-01
DAV: 12 -0.901731488917E+02 -0.33900E-02 -0.62239E-03 632 0.453E-01 0.124E-01
DAV: 13 -0.901757378419E+02 -0.25890E-02 -0.12366E-03 896 0.296E-01 0.693E-02
DAV: 14 -0.901791320601E+02 -0.33942E-02 -0.13446E-03 640 0.175E-01 0.520E-02
DAV: 15 -0.901812460702E+02 -0.21140E-02 -0.27660E-04 680 0.105E-01 0.361E-02
DAV: 16 -0.901828808191E+02 -0.16347E-02 -0.71563E-04 656 0.152E-01 0.396E-02
DAV: 17 -0.901835214234E+02 -0.64060E-03 -0.15409E-04 904 0.914E-02 0.193E-02
DAV: 18 -0.901837077012E+02 -0.18628E-03 -0.35981E-05 696 0.362E-02 0.121E-02
DAV: 19 -0.901839856999E+02 -0.27800E-03 -0.58947E-05 639 0.467E-02 0.686E-03
DAV: 20 -0.901840094430E+02 -0.23743E-04 -0.94311E-06 504 0.176E-02 0.762E-03
DAV: 21 -0.901840468984E+02 -0.37455E-04 -0.44697E-06 420 0.128E-02 0.471E-03
DAV: 22 -0.901840825676E+02 -0.35669E-04 -0.11267E-05 458 0.198E-02 0.305E-03
DAV: 23 -0.901840880439E+02 -0.54764E-05 -0.23068E-06 480 0.826E-03
1 F= -.90184088E+02 E0= -.90189977E+02 d E =0.176655E-01