./iterations/neb0_image03_iter272_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 0.363927324096E+03 0.36393E+03 -0.14330E+04 632 0.799E+02
DAV: 2 0.827340625376E+00 -0.36310E+03 -0.35115E+03 853 0.195E+02
DAV: 3 -0.960271166840E+02 -0.96854E+02 -0.96552E+02 661 0.116E+02
DAV: 4 -0.100352413662E+03 -0.43253E+01 -0.43152E+01 712 0.281E+01
DAV: 5 -0.100436688122E+03 -0.84274E-01 -0.84251E-01 736 0.352E+00 0.223E+01
DAV: 6 -0.917218026379E+02 0.87149E+01 -0.31345E+01 672 0.300E+01 0.118E+01
DAV: 7 -0.908758669584E+02 0.84594E+00 -0.18091E+00 712 0.634E+00 0.485E+00
DAV: 8 -0.904845202203E+02 0.39135E+00 -0.55513E-01 696 0.429E+00 0.170E+00
DAV: 9 -0.903940288102E+02 0.90491E-01 -0.13848E-01 704 0.169E+00 0.441E-01
DAV: 10 -0.903880607919E+02 0.59680E-02 -0.47522E-02 720 0.126E+00 0.336E-01
DAV: 11 -0.903915799840E+02 -0.35192E-02 -0.65674E-03 632 0.578E-01 0.136E-01
DAV: 12 -0.903954131576E+02 -0.38332E-02 -0.70921E-03 613 0.413E-01 0.128E-01
DAV: 13 -0.903993353046E+02 -0.39221E-02 -0.16129E-03 834 0.310E-01 0.838E-02
DAV: 14 -0.904025120491E+02 -0.31767E-02 -0.12236E-03 645 0.158E-01 0.584E-02
DAV: 15 -0.904047850238E+02 -0.22730E-02 -0.41124E-04 688 0.111E-01 0.335E-02
DAV: 16 -0.904061089875E+02 -0.13240E-02 -0.41394E-04 653 0.108E-01 0.271E-02
DAV: 17 -0.904069035423E+02 -0.79455E-03 -0.14017E-04 706 0.725E-02 0.115E-02
DAV: 18 -0.904071708574E+02 -0.26732E-03 -0.58822E-05 672 0.388E-02 0.106E-02
DAV: 19 -0.904072739435E+02 -0.10309E-03 -0.93726E-06 480 0.212E-02 0.530E-03
DAV: 20 -0.904073496835E+02 -0.75740E-04 -0.25755E-05 565 0.269E-02 0.639E-03
DAV: 21 -0.904073817816E+02 -0.32098E-04 -0.57488E-06 480 0.192E-02 0.198E-03
DAV: 22 -0.904073877782E+02 -0.59966E-05 -0.44672E-06 544 0.105E-02
1 F= -.90407388E+02 E0= -.90415251E+02 d E =0.235907E-01