./iterations/neb0_image07_iter155_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 0.370844171993E+03 0.37084E+03 -0.14314E+04 632 0.799E+02
DAV: 2 0.326983917643E+01 -0.36757E+03 -0.35505E+03 869 0.194E+02
DAV: 3 -0.963889085617E+02 -0.99659E+02 -0.99333E+02 685 0.116E+02
DAV: 4 -0.100968433748E+03 -0.45795E+01 -0.45674E+01 696 0.282E+01
DAV: 5 -0.101062930236E+03 -0.94496E-01 -0.94426E-01 736 0.361E+00 0.225E+01
DAV: 6 -0.925013160578E+02 0.85616E+01 -0.30520E+01 728 0.298E+01 0.118E+01
DAV: 7 -0.916604094658E+02 0.84091E+00 -0.17271E+00 712 0.617E+00 0.477E+00
DAV: 8 -0.912919677415E+02 0.36844E+00 -0.52348E-01 720 0.394E+00 0.164E+00
DAV: 9 -0.912101689896E+02 0.81799E-01 -0.12958E-01 728 0.157E+00 0.422E-01
DAV: 10 -0.912016986630E+02 0.84703E-02 -0.39996E-02 768 0.106E+00 0.287E-01
DAV: 11 -0.912059060152E+02 -0.42074E-02 -0.10680E-02 608 0.549E-01 0.135E-01
DAV: 12 -0.912085395896E+02 -0.26336E-02 -0.21752E-03 642 0.241E-01 0.945E-02
DAV: 13 -0.912125334291E+02 -0.39938E-02 -0.16214E-03 636 0.209E-01 0.499E-02
DAV: 14 -0.912149410755E+02 -0.24076E-02 -0.36447E-04 784 0.144E-01 0.275E-02
DAV: 15 -0.912172605354E+02 -0.23195E-02 -0.33223E-04 652 0.857E-02 0.293E-02
DAV: 16 -0.912183147453E+02 -0.10542E-02 -0.11393E-04 688 0.585E-02 0.102E-02
DAV: 17 -0.912190855900E+02 -0.77084E-03 -0.10781E-04 666 0.476E-02 0.133E-02
DAV: 18 -0.912192499647E+02 -0.16437E-03 -0.25149E-05 624 0.365E-02 0.643E-03
DAV: 19 -0.912193186555E+02 -0.68691E-04 -0.15707E-05 482 0.225E-02 0.724E-03
DAV: 20 -0.912193598399E+02 -0.41184E-04 -0.74517E-06 447 0.172E-02 0.375E-03
DAV: 21 -0.912193778294E+02 -0.17990E-04 -0.52550E-06 469 0.138E-02 0.185E-03
DAV: 22 -0.912193889873E+02 -0.11158E-04 -0.16509E-06 411 0.813E-03 0.933E-04
DAV: 23 -0.912193921810E+02 -0.31937E-05 -0.89646E-07 472 0.429E-03
1 F= -.91219392E+02 E0= -.91224435E+02 d E =0.151292E-01