./iterations/neb0_image06_iter58_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 0.374880094468E+03 0.37488E+03 -0.14306E+04 632 0.799E+02
DAV: 2 0.469490098092E+01 -0.37019E+03 -0.35696E+03 861 0.195E+02
DAV: 3 -0.954602158992E+02 -0.10016E+03 -0.99825E+02 664 0.117E+02
DAV: 4 -0.100002538244E+03 -0.45423E+01 -0.45314E+01 696 0.287E+01
DAV: 5 -0.100096836227E+03 -0.94298E-01 -0.94259E-01 728 0.367E+00 0.225E+01
DAV: 6 -0.915214657717E+02 0.85754E+01 -0.30732E+01 677 0.305E+01 0.117E+01
DAV: 7 -0.906889248596E+02 0.83254E+00 -0.16849E+00 728 0.623E+00 0.480E+00
DAV: 8 -0.903051788980E+02 0.38375E+00 -0.53440E-01 696 0.406E+00 0.163E+00
DAV: 9 -0.902149622060E+02 0.90217E-01 -0.12882E-01 720 0.163E+00 0.428E-01
DAV: 10 -0.902049618906E+02 0.10000E-01 -0.44036E-02 725 0.107E+00 0.312E-01
DAV: 11 -0.902096024021E+02 -0.46405E-02 -0.14807E-02 610 0.767E-01 0.182E-01
DAV: 12 -0.902106421670E+02 -0.10398E-02 -0.34050E-03 684 0.319E-01 0.135E-01
DAV: 13 -0.902151728385E+02 -0.45307E-02 -0.45460E-03 619 0.468E-01 0.904E-02
DAV: 14 -0.902170825839E+02 -0.19097E-02 -0.82971E-04 704 0.183E-01 0.745E-02
DAV: 15 -0.902194719602E+02 -0.23894E-02 -0.86897E-04 637 0.178E-01 0.314E-02
DAV: 16 -0.902216972061E+02 -0.22252E-02 -0.36615E-04 666 0.970E-02 0.281E-02
DAV: 17 -0.902225490526E+02 -0.85185E-03 -0.73619E-05 728 0.523E-02 0.206E-02
DAV: 18 -0.902231967882E+02 -0.64774E-03 -0.17987E-04 695 0.820E-02 0.136E-02
DAV: 19 -0.902233129374E+02 -0.11615E-03 -0.23547E-05 608 0.358E-02 0.998E-03
DAV: 20 -0.902234018778E+02 -0.88940E-04 -0.14842E-05 428 0.194E-02 0.475E-03
DAV: 21 -0.902234772409E+02 -0.75363E-04 -0.12257E-05 436 0.155E-02 0.313E-03
DAV: 22 -0.902234888449E+02 -0.11604E-04 -0.30602E-06 520 0.115E-02 0.265E-03
DAV: 23 -0.902234960188E+02 -0.71740E-05 -0.20219E-06 392 0.909E-03
1 F= -.90223496E+02 E0= -.90229595E+02 d E =0.182962E-01