./iterations/neb0_image07_iter91_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 0.790937622405E+03 0.79094E+03 -0.25997E+04 920 0.101E+03
DAV: 2 0.100696032753E+03 -0.69024E+03 -0.67338E+03 1112 0.280E+02
DAV: 3 -0.627358999282E+02 -0.16343E+03 -0.16295E+03 816 0.154E+02
DAV: 4 -0.673724450168E+02 -0.46365E+01 -0.46138E+01 928 0.292E+01
DAV: 5 -0.674250270378E+02 -0.52582E-01 -0.52495E-01 854 0.311E+00 0.194E+01
DAV: 6 -0.624363177429E+02 0.49887E+01 -0.19480E+01 856 0.249E+01 0.105E+01
DAV: 7 -0.622418447778E+02 0.19447E+00 -0.13366E+00 880 0.773E+00 0.405E+00
DAV: 8 -0.621942271145E+02 0.47618E-01 -0.13007E-01 928 0.283E+00 0.156E+00
DAV: 9 -0.621833438779E+02 0.10883E-01 -0.33631E-02 880 0.167E+00 0.364E-01
DAV: 10 -0.621802051383E+02 0.31387E-02 -0.10880E-02 928 0.881E-01 0.224E-01
DAV: 11 -0.621798540558E+02 0.35108E-03 -0.25240E-03 912 0.532E-01 0.922E-02
DAV: 12 -0.621813709918E+02 -0.15169E-02 -0.16647E-03 992 0.431E-01 0.701E-02
DAV: 13 -0.621837413059E+02 -0.23703E-02 -0.96342E-04 907 0.309E-01 0.659E-02
DAV: 14 -0.621856325656E+02 -0.18913E-02 -0.53685E-04 915 0.171E-01 0.352E-02
DAV: 15 -0.621867934163E+02 -0.11609E-02 -0.11806E-04 920 0.609E-02 0.172E-02
DAV: 16 -0.621874851437E+02 -0.69173E-03 -0.42474E-05 784 0.359E-02 0.120E-02
DAV: 17 -0.621880234453E+02 -0.53830E-03 -0.38016E-05 739 0.254E-02 0.802E-03
DAV: 18 -0.621882100849E+02 -0.18664E-03 -0.10144E-05 664 0.173E-02 0.358E-03
DAV: 19 -0.621882690017E+02 -0.58917E-04 -0.33632E-06 635 0.830E-03 0.163E-03
DAV: 20 -0.621882977280E+02 -0.28726E-04 -0.19160E-06 598 0.772E-03 0.135E-03
DAV: 21 -0.621883074841E+02 -0.97560E-05 -0.46454E-07 544 0.443E-03
1 F= -.62188307E+02 E0= -.62192173E+02 d E =0.115966E-01