./iterations/neb0_image05_iter277_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 0.368051069673E+03 0.36805E+03 -0.14312E+04 624 0.799E+02
DAV: 2 0.414198726856E+01 -0.36391E+03 -0.35081E+03 845 0.196E+02
DAV: 3 -0.952326093452E+02 -0.99375E+02 -0.99027E+02 637 0.117E+02
DAV: 4 -0.100140604884E+03 -0.49080E+01 -0.48955E+01 704 0.302E+01
DAV: 5 -0.100239503140E+03 -0.98898E-01 -0.98853E-01 728 0.384E+00 0.223E+01
DAV: 6 -0.915789000031E+02 0.86606E+01 -0.30953E+01 688 0.299E+01 0.117E+01
DAV: 7 -0.907481200188E+02 0.83078E+00 -0.17504E+00 712 0.634E+00 0.484E+00
DAV: 8 -0.903681165468E+02 0.38000E+00 -0.55000E-01 720 0.437E+00 0.172E+00
DAV: 9 -0.902858044285E+02 0.82312E-01 -0.12107E-01 728 0.194E+00 0.521E-01
DAV: 10 -0.902751164223E+02 0.10688E-01 -0.25086E-02 720 0.871E-01 0.324E-01
DAV: 11 -0.902761645570E+02 -0.10481E-02 -0.13178E-02 696 0.661E-01 0.256E-01
DAV: 12 -0.902776840662E+02 -0.15195E-02 -0.24520E-03 794 0.487E-01 0.127E-01
DAV: 13 -0.902819626754E+02 -0.42786E-02 -0.45012E-03 632 0.401E-01 0.129E-01
DAV: 14 -0.902838584904E+02 -0.18958E-02 -0.11160E-03 840 0.225E-01 0.614E-02
DAV: 15 -0.902877537295E+02 -0.38952E-02 -0.11487E-03 643 0.171E-01 0.392E-02
DAV: 16 -0.902901025779E+02 -0.23488E-02 -0.25012E-04 712 0.854E-02 0.329E-02
DAV: 17 -0.902917804659E+02 -0.16779E-02 -0.34657E-04 658 0.943E-02 0.181E-02
DAV: 18 -0.902923771242E+02 -0.59666E-03 -0.76251E-05 688 0.546E-02 0.119E-02
DAV: 19 -0.902925634487E+02 -0.18632E-03 -0.65175E-05 672 0.421E-02 0.932E-03
DAV: 20 -0.902926283356E+02 -0.64887E-04 -0.92319E-06 480 0.266E-02 0.366E-03
DAV: 21 -0.902926733196E+02 -0.44984E-04 -0.26892E-05 540 0.261E-02 0.684E-03
DAV: 22 -0.902926773603E+02 -0.40407E-05 -0.17623E-06 528 0.116E-02
1 F= -.90292677E+02 E0= -.90300626E+02 d E =0.238457E-01