./iterations/neb0_image02_iter144_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 0.363755007235E+03 0.36376E+03 -0.14327E+04 632 0.799E+02
DAV: 2 0.283112619274E+01 -0.36092E+03 -0.34755E+03 845 0.195E+02
DAV: 3 -0.955400530643E+02 -0.98371E+02 -0.98037E+02 656 0.116E+02
DAV: 4 -0.100192124026E+03 -0.46521E+01 -0.46406E+01 720 0.290E+01
DAV: 5 -0.100283134810E+03 -0.91011E-01 -0.90980E-01 728 0.366E+00 0.222E+01
DAV: 6 -0.916694045573E+02 0.86137E+01 -0.31021E+01 688 0.299E+01 0.117E+01
DAV: 7 -0.908600806218E+02 0.80932E+00 -0.18415E+00 704 0.637E+00 0.484E+00
DAV: 8 -0.904785260227E+02 0.38155E+00 -0.55744E-01 704 0.429E+00 0.169E+00
DAV: 9 -0.903911859557E+02 0.87340E-01 -0.13784E-01 696 0.167E+00 0.433E-01
DAV: 10 -0.903853397172E+02 0.58462E-02 -0.50476E-02 712 0.133E+00 0.331E-01
DAV: 11 -0.903887041702E+02 -0.33645E-02 -0.73948E-03 608 0.520E-01 0.152E-01
DAV: 12 -0.903920723721E+02 -0.33682E-02 -0.83674E-03 640 0.509E-01 0.138E-01
DAV: 13 -0.903947215996E+02 -0.26492E-02 -0.18755E-03 936 0.355E-01 0.841E-02
DAV: 14 -0.903977338743E+02 -0.30123E-02 -0.13906E-03 645 0.179E-01 0.639E-02
DAV: 15 -0.903999222590E+02 -0.21884E-02 -0.42264E-04 664 0.111E-01 0.507E-02
DAV: 16 -0.904013678425E+02 -0.14456E-02 -0.78892E-04 664 0.167E-01 0.320E-02
DAV: 17 -0.904022402415E+02 -0.87240E-03 -0.14087E-04 666 0.769E-02 0.257E-02
DAV: 18 -0.904024788058E+02 -0.23856E-03 -0.67141E-05 680 0.405E-02 0.112E-02
DAV: 19 -0.904026828961E+02 -0.20409E-03 -0.53254E-05 620 0.377E-02 0.793E-03
DAV: 20 -0.904026986626E+02 -0.15766E-04 -0.55104E-06 496 0.200E-02 0.637E-03
DAV: 21 -0.904027250436E+02 -0.26381E-04 -0.78605E-06 437 0.160E-02 0.662E-03
DAV: 22 -0.904027513292E+02 -0.26286E-04 -0.47164E-06 447 0.148E-02 0.318E-03
DAV: 23 -0.904027562352E+02 -0.49060E-05 -0.66836E-06 480 0.145E-02
1 F= -.90402756E+02 E0= -.90408751E+02 d E =0.179841E-01