./iterations/neb0_image05_iter280_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 0.368192595917E+03 0.36819E+03 -0.14313E+04 624 0.799E+02
DAV: 2 0.421804940607E+01 -0.36397E+03 -0.35088E+03 845 0.196E+02
DAV: 3 -0.952662318366E+02 -0.99484E+02 -0.99135E+02 637 0.117E+02
DAV: 4 -0.100183456605E+03 -0.49172E+01 -0.49048E+01 704 0.303E+01
DAV: 5 -0.100282238911E+03 -0.98782E-01 -0.98737E-01 736 0.384E+00 0.223E+01
DAV: 6 -0.916093474965E+02 0.86729E+01 -0.31068E+01 680 0.300E+01 0.118E+01
DAV: 7 -0.907789299751E+02 0.83042E+00 -0.17531E+00 712 0.628E+00 0.484E+00
DAV: 8 -0.903980353126E+02 0.38089E+00 -0.54695E-01 720 0.430E+00 0.170E+00
DAV: 9 -0.903112323082E+02 0.86803E-01 -0.12590E-01 728 0.179E+00 0.460E-01
DAV: 10 -0.903033545556E+02 0.78778E-02 -0.25170E-02 720 0.883E-01 0.308E-01
DAV: 11 -0.903042676596E+02 -0.91310E-03 -0.72600E-03 680 0.426E-01 0.186E-01
DAV: 12 -0.903076878310E+02 -0.34202E-02 -0.47122E-03 616 0.412E-01 0.111E-01
DAV: 13 -0.903104144340E+02 -0.27266E-02 -0.10554E-03 648 0.188E-01 0.855E-02
DAV: 14 -0.903150962093E+02 -0.46818E-02 -0.22809E-03 638 0.253E-01 0.573E-02
DAV: 15 -0.903176451151E+02 -0.25489E-02 -0.42590E-04 749 0.145E-01 0.305E-02
DAV: 16 -0.903199444785E+02 -0.22994E-02 -0.67007E-04 658 0.129E-01 0.338E-02
DAV: 17 -0.903206821002E+02 -0.73762E-03 -0.99526E-05 768 0.758E-02 0.162E-02
DAV: 18 -0.903212145018E+02 -0.53240E-03 -0.13432E-04 647 0.615E-02 0.995E-03
DAV: 19 -0.903213984266E+02 -0.18392E-03 -0.16616E-05 488 0.205E-02 0.910E-03
DAV: 20 -0.903214846197E+02 -0.86193E-04 -0.15626E-05 489 0.215E-02 0.414E-03
DAV: 21 -0.903215156564E+02 -0.31037E-04 -0.12916E-05 488 0.200E-02 0.425E-03
DAV: 22 -0.903215263222E+02 -0.10666E-04 -0.21793E-06 428 0.845E-03 0.316E-03
DAV: 23 -0.903215297319E+02 -0.34097E-05 -0.27839E-06 461 0.113E-02
1 F= -.90321530E+02 E0= -.90329535E+02 d E =0.240157E-01