./iterations/neb0_image02_iter120_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 0.364886093462E+03 0.36489E+03 -0.14330E+04 632 0.799E+02
DAV: 2 0.398576605860E+01 -0.36090E+03 -0.34634E+03 834 0.195E+02
DAV: 3 -0.955863597057E+02 -0.99572E+02 -0.99240E+02 672 0.116E+02
DAV: 4 -0.100207447631E+03 -0.46211E+01 -0.46100E+01 712 0.286E+01
DAV: 5 -0.100296488038E+03 -0.89040E-01 -0.89003E-01 728 0.357E+00 0.222E+01
DAV: 6 -0.916734085904E+02 0.86231E+01 -0.30926E+01 696 0.299E+01 0.117E+01
DAV: 7 -0.908526957786E+02 0.82071E+00 -0.18430E+00 704 0.634E+00 0.483E+00
DAV: 8 -0.904686408585E+02 0.38405E+00 -0.55566E-01 696 0.427E+00 0.169E+00
DAV: 9 -0.903794601286E+02 0.89181E-01 -0.13938E-01 704 0.166E+00 0.433E-01
DAV: 10 -0.903734026779E+02 0.60575E-02 -0.48723E-02 696 0.131E+00 0.326E-01
DAV: 11 -0.903768996403E+02 -0.34970E-02 -0.71849E-03 608 0.500E-01 0.151E-01
DAV: 12 -0.903803453282E+02 -0.34457E-02 -0.81203E-03 624 0.499E-01 0.138E-01
DAV: 13 -0.903830155987E+02 -0.26703E-02 -0.18042E-03 920 0.353E-01 0.805E-02
DAV: 14 -0.903860821407E+02 -0.30665E-02 -0.13996E-03 640 0.177E-01 0.612E-02
DAV: 15 -0.903882813346E+02 -0.21992E-02 -0.37525E-04 669 0.107E-01 0.457E-02
DAV: 16 -0.903897913390E+02 -0.15100E-02 -0.74787E-04 656 0.157E-01 0.339E-02
DAV: 17 -0.903906330167E+02 -0.84168E-03 -0.13847E-04 677 0.789E-02 0.243E-02
DAV: 18 -0.903908374810E+02 -0.20446E-03 -0.69000E-05 680 0.421E-02 0.985E-03
DAV: 19 -0.903910088288E+02 -0.17135E-03 -0.27049E-05 506 0.266E-02 0.337E-03
DAV: 20 -0.903910619584E+02 -0.53130E-04 -0.59885E-06 480 0.133E-02 0.536E-03
DAV: 21 -0.903910993556E+02 -0.37397E-04 -0.53153E-06 431 0.139E-02 0.488E-03
DAV: 22 -0.903911171441E+02 -0.17788E-04 -0.44876E-06 477 0.126E-02 0.295E-03
DAV: 23 -0.903911188741E+02 -0.17300E-05 -0.38986E-06 544 0.114E-02
1 F= -.90391119E+02 E0= -.90397144E+02 d E =0.180748E-01