./iterations/neb0_image06_iter204_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 0.370891674142E+03 0.37089E+03 -0.14347E+04 640 0.799E+02
DAV: 2 0.442808312011E+01 -0.36646E+03 -0.35444E+03 858 0.193E+02
DAV: 3 -0.956854852107E+02 -0.10011E+03 -0.99781E+02 672 0.116E+02
DAV: 4 -0.100412971569E+03 -0.47275E+01 -0.47138E+01 720 0.288E+01
DAV: 5 -0.100509656996E+03 -0.96685E-01 -0.96624E-01 736 0.367E+00 0.226E+01
DAV: 6 -0.919339289452E+02 0.85757E+01 -0.30630E+01 701 0.302E+01 0.118E+01
DAV: 7 -0.911110317279E+02 0.82290E+00 -0.17577E+00 704 0.627E+00 0.480E+00
DAV: 8 -0.907356595174E+02 0.37537E+00 -0.54048E-01 704 0.409E+00 0.167E+00
DAV: 9 -0.906448601969E+02 0.90799E-01 -0.12945E-01 704 0.157E+00 0.422E-01
DAV: 10 -0.906346196245E+02 0.10241E-01 -0.37927E-02 744 0.966E-01 0.286E-01
DAV: 11 -0.906389134784E+02 -0.42939E-02 -0.96586E-03 599 0.505E-01 0.146E-01
DAV: 12 -0.906416487855E+02 -0.27353E-02 -0.22037E-03 634 0.253E-01 0.845E-02
DAV: 13 -0.906457266639E+02 -0.40779E-02 -0.15236E-03 642 0.181E-01 0.616E-02
DAV: 14 -0.906489834851E+02 -0.32568E-02 -0.92481E-04 736 0.218E-01 0.371E-02
DAV: 15 -0.906508835746E+02 -0.19001E-02 -0.29898E-04 626 0.934E-02 0.394E-02
DAV: 16 -0.906521759835E+02 -0.12924E-02 -0.32868E-04 717 0.111E-01 0.182E-02
DAV: 17 -0.906528745247E+02 -0.69854E-03 -0.11697E-04 653 0.577E-02 0.138E-02
DAV: 18 -0.906531305872E+02 -0.25606E-03 -0.23159E-05 536 0.221E-02 0.844E-03
DAV: 19 -0.906532662601E+02 -0.13567E-03 -0.20841E-05 489 0.221E-02 0.237E-03
DAV: 20 -0.906532919760E+02 -0.25716E-04 -0.39836E-06 496 0.103E-02 0.172E-03
DAV: 21 -0.906533167579E+02 -0.24782E-04 -0.36722E-06 395 0.696E-03 0.198E-03
DAV: 22 -0.906533186194E+02 -0.18615E-05 -0.51207E-07 504 0.350E-03
1 F= -.90653319E+02 E0= -.90658184E+02 d E =0.145961E-01