./iterations/neb0_image07_iter228_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 0.371155603564E+03 0.37116E+03 -0.14323E+04 632 0.799E+02
DAV: 2 0.374864482289E+01 -0.36741E+03 -0.35545E+03 869 0.194E+02
DAV: 3 -0.965891826432E+02 -0.10034E+03 -0.10003E+03 693 0.116E+02
DAV: 4 -0.101087874907E+03 -0.44987E+01 -0.44867E+01 696 0.277E+01
DAV: 5 -0.101178370990E+03 -0.90496E-01 -0.90437E-01 736 0.352E+00 0.226E+01
DAV: 6 -0.925730428412E+02 0.86053E+01 -0.30712E+01 717 0.299E+01 0.118E+01
DAV: 7 -0.917245603781E+02 0.84848E+00 -0.17359E+00 728 0.619E+00 0.480E+00
DAV: 8 -0.913506438187E+02 0.37392E+00 -0.54717E-01 728 0.398E+00 0.161E+00
DAV: 9 -0.912700227632E+02 0.80621E-01 -0.13014E-01 720 0.156E+00 0.420E-01
DAV: 10 -0.912613400025E+02 0.86828E-02 -0.39562E-02 768 0.102E+00 0.284E-01
DAV: 11 -0.912656891011E+02 -0.43491E-02 -0.10977E-02 616 0.548E-01 0.140E-01
DAV: 12 -0.912687181233E+02 -0.30290E-02 -0.25326E-03 624 0.263E-01 0.859E-02
DAV: 13 -0.912724990636E+02 -0.37809E-02 -0.13716E-03 639 0.174E-01 0.549E-02
DAV: 14 -0.912757742597E+02 -0.32752E-02 -0.10247E-03 786 0.244E-01 0.516E-02
DAV: 15 -0.912770991327E+02 -0.13249E-02 -0.39035E-04 680 0.117E-01 0.384E-02
DAV: 16 -0.912781048929E+02 -0.10058E-02 -0.20716E-04 760 0.808E-02 0.146E-02
DAV: 17 -0.912789546373E+02 -0.84974E-03 -0.13001E-04 704 0.588E-02 0.143E-02
DAV: 18 -0.912792169936E+02 -0.26236E-03 -0.21809E-05 544 0.250E-02 0.842E-03
DAV: 19 -0.912793322257E+02 -0.11523E-03 -0.26221E-05 560 0.271E-02 0.373E-03
DAV: 20 -0.912793602436E+02 -0.28018E-04 -0.30379E-06 488 0.114E-02 0.207E-03
DAV: 21 -0.912793718155E+02 -0.11572E-04 -0.12591E-06 440 0.515E-03 0.115E-03
DAV: 22 -0.912793822230E+02 -0.10408E-04 -0.15672E-06 431 0.576E-03 0.101E-03
DAV: 23 -0.912793825139E+02 -0.29090E-06 -0.29137E-07 536 0.298E-03
1 F= -.91279383E+02 E0= -.91284743E+02 d E =0.160811E-01