./iterations/neb0_image05_iter12_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 0.356143169835E+03 0.35614E+03 -0.14202E+04 632 0.799E+02
DAV: 2 0.550279796544E+01 -0.35064E+03 -0.33901E+03 858 0.191E+02
DAV: 3 -0.909065843035E+02 -0.96409E+02 -0.95833E+02 693 0.114E+02
DAV: 4 -0.957394718466E+02 -0.48329E+01 -0.48134E+01 704 0.279E+01
DAV: 5 -0.958512673677E+02 -0.11180E+00 -0.11174E+00 728 0.369E+00 0.210E+01
DAV: 6 -0.877797885090E+02 0.80715E+01 -0.31124E+01 728 0.301E+01 0.109E+01
DAV: 7 -0.870828977485E+02 0.69689E+00 -0.16801E+00 728 0.746E+00 0.476E+00
DAV: 8 -0.867429347999E+02 0.33996E+00 -0.67396E-01 728 0.449E+00 0.170E+00
DAV: 9 -0.866703378430E+02 0.72597E-01 -0.15265E-01 728 0.193E+00 0.534E-01
DAV: 10 -0.866628522476E+02 0.74856E-02 -0.23577E-02 832 0.943E-01 0.260E-01
DAV: 11 -0.866632377373E+02 -0.38549E-03 -0.80006E-03 632 0.498E-01 0.172E-01
DAV: 12 -0.866664518400E+02 -0.32141E-02 -0.42601E-03 680 0.377E-01 0.982E-02
DAV: 13 -0.866706105433E+02 -0.41587E-02 -0.16062E-03 665 0.242E-01 0.731E-02
DAV: 14 -0.866732305283E+02 -0.26200E-02 -0.80263E-04 677 0.137E-01 0.379E-02
DAV: 15 -0.866756946780E+02 -0.24641E-02 -0.70183E-04 757 0.160E-01 0.443E-02
DAV: 16 -0.866764946472E+02 -0.79997E-03 -0.22280E-04 776 0.107E-01 0.247E-02
DAV: 17 -0.866771171285E+02 -0.62248E-03 -0.21567E-04 722 0.893E-02 0.210E-02
DAV: 18 -0.866776074939E+02 -0.49037E-03 -0.11707E-04 725 0.574E-02 0.149E-02
DAV: 19 -0.866777642544E+02 -0.15676E-03 -0.18001E-05 469 0.269E-02 0.852E-03
DAV: 20 -0.866779120932E+02 -0.14784E-03 -0.61794E-05 612 0.416E-02 0.939E-03
DAV: 21 -0.866779293038E+02 -0.17211E-04 -0.62747E-06 512 0.192E-02 0.533E-03
DAV: 22 -0.866779453310E+02 -0.16027E-04 -0.12343E-05 409 0.191E-02 0.314E-03
DAV: 23 -0.866779514233E+02 -0.60924E-05 -0.18273E-06 488 0.756E-03
1 F= -.86677951E+02 E0= -.86681837E+02 d E =0.116562E-01