./iterations/neb0_image03_iter295_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 0.363427085350E+03 0.36343E+03 -0.14324E+04 632 0.799E+02
DAV: 2 0.578205862900E+00 -0.36285E+03 -0.35120E+03 861 0.195E+02
DAV: 3 -0.959769272443E+02 -0.96555E+02 -0.96245E+02 664 0.115E+02
DAV: 4 -0.100294345602E+03 -0.43174E+01 -0.43088E+01 704 0.280E+01
DAV: 5 -0.100377906962E+03 -0.83561E-01 -0.83539E-01 736 0.350E+00 0.223E+01
DAV: 6 -0.916949201655E+02 0.86830E+01 -0.31458E+01 672 0.300E+01 0.117E+01
DAV: 7 -0.908616876653E+02 0.83323E+00 -0.17836E+00 704 0.628E+00 0.484E+00
DAV: 8 -0.904742751008E+02 0.38741E+00 -0.55037E-01 704 0.426E+00 0.171E+00
DAV: 9 -0.903853145015E+02 0.88961E-01 -0.14138E-01 704 0.173E+00 0.448E-01
DAV: 10 -0.903791535172E+02 0.61610E-02 -0.44119E-02 712 0.124E+00 0.329E-01
DAV: 11 -0.903821998234E+02 -0.30463E-02 -0.55738E-03 640 0.553E-01 0.145E-01
DAV: 12 -0.903859070512E+02 -0.37072E-02 -0.63411E-03 616 0.395E-01 0.116E-01
DAV: 13 -0.903900579707E+02 -0.41509E-02 -0.10702E-03 834 0.248E-01 0.723E-02
DAV: 14 -0.903935804186E+02 -0.35224E-02 -0.13341E-03 645 0.160E-01 0.501E-02
DAV: 15 -0.903958159896E+02 -0.22356E-02 -0.30554E-04 728 0.103E-01 0.234E-02
DAV: 16 -0.903972092783E+02 -0.13933E-02 -0.35707E-04 650 0.101E-01 0.299E-02
DAV: 17 -0.903977156381E+02 -0.50636E-03 -0.13469E-04 717 0.808E-02 0.129E-02
DAV: 18 -0.903979816800E+02 -0.26604E-03 -0.65231E-05 648 0.419E-02 0.119E-02
DAV: 19 -0.903981125383E+02 -0.13086E-03 -0.11643E-05 474 0.237E-02 0.685E-03
DAV: 20 -0.903981944013E+02 -0.81863E-04 -0.27747E-05 576 0.282E-02 0.489E-03
DAV: 21 -0.903982309869E+02 -0.36586E-04 -0.52994E-06 458 0.203E-02 0.165E-03
DAV: 22 -0.903982401072E+02 -0.91203E-05 -0.45358E-06 480 0.105E-02
1 F= -.90398240E+02 E0= -.90406588E+02 d E =0.250437E-01