./iterations/neb0_image08_iter94_OSZICAR.out output for 40: 572-->565: F2 + F3Si-NF-SiF3, to SiF4 + F3Si-NF2 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.791629461292E+03 0.79163E+03 -0.26041E+04 920 0.101E+03
DAV: 2 0.997710600400E+02 -0.69186E+03 -0.67571E+03 1112 0.281E+02
DAV: 3 -0.632634402747E+02 -0.16303E+03 -0.16250E+03 825 0.154E+02
DAV: 4 -0.680162372402E+02 -0.47528E+01 -0.47430E+01 872 0.288E+01
DAV: 5 -0.680821072106E+02 -0.65870E-01 -0.65652E-01 902 0.326E+00 0.198E+01
DAV: 6 -0.634803336160E+02 0.46018E+01 -0.18824E+01 865 0.220E+01 0.109E+01
DAV: 7 -0.633307376172E+02 0.14960E+00 -0.92208E-01 889 0.541E+00 0.399E+00
DAV: 8 -0.633270827251E+02 0.36549E-02 -0.87283E-02 880 0.196E+00 0.137E+00
DAV: 9 -0.633374676210E+02 -0.10385E-01 -0.18035E-02 918 0.939E-01 0.325E-01
DAV: 10 -0.633395455173E+02 -0.20779E-02 -0.52305E-03 928 0.556E-01 0.152E-01
DAV: 11 -0.633404331449E+02 -0.88763E-03 -0.65032E-04 854 0.190E-01 0.743E-02
DAV: 12 -0.633418008208E+02 -0.13677E-02 -0.38475E-04 859 0.141E-01 0.326E-02
DAV: 13 -0.633427741392E+02 -0.97332E-03 -0.13511E-04 827 0.990E-02 0.325E-02
DAV: 14 -0.633435613187E+02 -0.78718E-03 -0.15907E-04 881 0.888E-02 0.166E-02
DAV: 15 -0.633438694433E+02 -0.30812E-03 -0.31726E-05 755 0.403E-02 0.670E-03
DAV: 16 -0.633440656766E+02 -0.19623E-03 -0.18381E-05 633 0.243E-02 0.485E-03
DAV: 17 -0.633441897381E+02 -0.12406E-03 -0.70316E-06 643 0.153E-02 0.268E-03
DAV: 18 -0.633442658469E+02 -0.76109E-04 -0.48149E-06 625 0.798E-03 0.171E-03
DAV: 19 -0.633443058707E+02 -0.40024E-04 -0.26342E-06 609 0.994E-03 0.138E-03
DAV: 20 -0.633443170591E+02 -0.11188E-04 -0.76480E-07 566 0.410E-03 0.106E-03
DAV: 21 -0.633443258436E+02 -0.87844E-05 -0.68006E-07 572 0.580E-03
1 F= -.63344326E+02 E0= -.63348191E+02 d E =0.115964E-01