./iterations/neb0_image05_iter293_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 0.367658044358E+03 0.36766E+03 -0.14308E+04 624 0.799E+02
DAV: 2 0.471126498493E+01 -0.36295E+03 -0.34927E+03 840 0.196E+02
DAV: 3 -0.951437227127E+02 -0.99855E+02 -0.99510E+02 637 0.117E+02
DAV: 4 -0.100117120564E+03 -0.49734E+01 -0.49605E+01 704 0.304E+01
DAV: 5 -0.100218221399E+03 -0.10110E+00 -0.10105E+00 725 0.388E+00 0.222E+01
DAV: 6 -0.915778084672E+02 0.86404E+01 -0.31062E+01 688 0.302E+01 0.117E+01
DAV: 7 -0.907577679354E+02 0.82004E+00 -0.17748E+00 720 0.649E+00 0.483E+00
DAV: 8 -0.903774019829E+02 0.38037E+00 -0.51776E-01 712 0.430E+00 0.178E+00
DAV: 9 -0.902896858606E+02 0.87716E-01 -0.14012E-01 720 0.193E+00 0.537E-01
DAV: 10 -0.902788129564E+02 0.10873E-01 -0.24723E-02 725 0.880E-01 0.325E-01
DAV: 11 -0.902798194999E+02 -0.10065E-02 -0.14726E-02 720 0.661E-01 0.205E-01
DAV: 12 -0.902832500412E+02 -0.34305E-02 -0.59846E-03 752 0.461E-01 0.121E-01
DAV: 13 -0.902856791361E+02 -0.24291E-02 -0.12095E-03 650 0.192E-01 0.958E-02
DAV: 14 -0.902899786507E+02 -0.42995E-02 -0.25730E-03 697 0.293E-01 0.622E-02
DAV: 15 -0.902921338598E+02 -0.21552E-02 -0.40196E-04 696 0.130E-01 0.417E-02
DAV: 16 -0.902949444820E+02 -0.28106E-02 -0.10266E-03 655 0.182E-01 0.378E-02
DAV: 17 -0.902956705892E+02 -0.72611E-03 -0.12639E-04 712 0.727E-02 0.291E-02
DAV: 18 -0.902962821908E+02 -0.61160E-03 -0.17920E-04 652 0.776E-02 0.102E-02
DAV: 19 -0.902965973682E+02 -0.31518E-03 -0.78475E-05 741 0.467E-02 0.153E-02
DAV: 20 -0.902966801191E+02 -0.82751E-04 -0.84084E-06 496 0.192E-02 0.112E-02
DAV: 21 -0.902967199320E+02 -0.39813E-04 -0.32806E-05 564 0.341E-02 0.392E-03
DAV: 22 -0.902967375513E+02 -0.17619E-04 -0.38576E-06 457 0.142E-02 0.292E-03
DAV: 23 -0.902967414907E+02 -0.39394E-05 -0.18335E-06 464 0.667E-03
1 F= -.90296741E+02 E0= -.90305129E+02 d E =0.251616E-01