./iterations/neb0_image08_iter38_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 0.801323128004E+03 0.80132E+03 -0.25981E+04 912 0.101E+03
DAV: 2 0.101756237667E+03 -0.69957E+03 -0.68219E+03 1112 0.282E+02
DAV: 3 -0.630538186076E+02 -0.16481E+03 -0.16446E+03 812 0.155E+02
DAV: 4 -0.677916475298E+02 -0.47378E+01 -0.47250E+01 888 0.291E+01
DAV: 5 -0.678527228630E+02 -0.61075E-01 -0.60858E-01 926 0.323E+00 0.200E+01
DAV: 6 -0.631627204012E+02 0.46900E+01 -0.18882E+01 915 0.226E+01 0.109E+01
DAV: 7 -0.630094698487E+02 0.15325E+00 -0.10284E+00 960 0.599E+00 0.399E+00
DAV: 8 -0.630032774921E+02 0.61924E-02 -0.98002E-02 920 0.218E+00 0.138E+00
DAV: 9 -0.630111185564E+02 -0.78411E-02 -0.21768E-02 928 0.107E+00 0.341E-01
DAV: 10 -0.630121635482E+02 -0.10450E-02 -0.57931E-03 918 0.643E-01 0.177E-01
DAV: 11 -0.630129787567E+02 -0.81521E-03 -0.77479E-04 854 0.222E-01 0.789E-02
DAV: 12 -0.630140935863E+02 -0.11148E-02 -0.34512E-04 849 0.170E-01 0.316E-02
DAV: 13 -0.630151176079E+02 -0.10240E-02 -0.21550E-04 903 0.149E-01 0.348E-02
DAV: 14 -0.630161238779E+02 -0.10063E-02 -0.23189E-04 796 0.127E-01 0.164E-02
DAV: 15 -0.630165987619E+02 -0.47488E-03 -0.58051E-05 836 0.519E-02 0.808E-03
DAV: 16 -0.630168380446E+02 -0.23928E-03 -0.16390E-05 664 0.237E-02 0.517E-03
DAV: 17 -0.630169920530E+02 -0.15401E-03 -0.81866E-06 654 0.142E-02 0.285E-03
DAV: 18 -0.630171104335E+02 -0.11838E-03 -0.94032E-06 609 0.124E-02 0.215E-03
DAV: 19 -0.630171407374E+02 -0.30304E-04 -0.20411E-06 640 0.896E-03 0.985E-04
DAV: 20 -0.630171585749E+02 -0.17837E-04 -0.11829E-06 591 0.449E-03 0.843E-04
DAV: 21 -0.630171641847E+02 -0.56098E-05 -0.36833E-07 499 0.370E-03
1 F= -.63017164E+02 E0= -.63021030E+02 d E =0.115964E-01