./iterations/neb0_image02_iter51_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 0.804897712911E+03 0.80490E+03 -0.25802E+04 904 0.101E+03
DAV: 2 0.108271378117E+03 -0.69663E+03 -0.68005E+03 1152 0.281E+02
DAV: 3 -0.597470848534E+02 -0.16802E+03 -0.16734E+03 848 0.154E+02
DAV: 4 -0.648437814415E+02 -0.50967E+01 -0.50815E+01 888 0.293E+01
DAV: 5 -0.649040291068E+02 -0.60248E-01 -0.60133E-01 860 0.327E+00 0.206E+01
DAV: 6 -0.597371854249E+02 0.51668E+01 -0.17789E+01 816 0.231E+01 0.108E+01
DAV: 7 -0.594644833610E+02 0.27270E+00 -0.13031E+00 875 0.645E+00 0.424E+00
DAV: 8 -0.594429540039E+02 0.21529E-01 -0.18308E-01 864 0.268E+00 0.125E+00
DAV: 9 -0.594475533738E+02 -0.45994E-02 -0.24677E-02 918 0.150E+00 0.364E-01
DAV: 10 -0.594494414895E+02 -0.18881E-02 -0.60978E-03 864 0.487E-01 0.180E-01
DAV: 11 -0.594509230851E+02 -0.14816E-02 -0.13960E-03 770 0.281E-01 0.688E-02
DAV: 12 -0.594523003091E+02 -0.13772E-02 -0.26952E-04 839 0.144E-01 0.299E-02
DAV: 13 -0.594537285479E+02 -0.14282E-02 -0.20053E-04 844 0.108E-01 0.226E-02
DAV: 14 -0.594545861822E+02 -0.85763E-03 -0.10742E-04 780 0.654E-02 0.135E-02
DAV: 15 -0.594551706755E+02 -0.58449E-03 -0.57769E-05 785 0.456E-02 0.768E-03
DAV: 16 -0.594553485132E+02 -0.17784E-03 -0.14682E-05 588 0.235E-02 0.458E-03
DAV: 17 -0.594555103493E+02 -0.16184E-03 -0.10353E-05 573 0.152E-02 0.283E-03
DAV: 18 -0.594555950695E+02 -0.84720E-04 -0.53084E-06 586 0.885E-03 0.150E-03
DAV: 19 -0.594556369812E+02 -0.41912E-04 -0.28570E-06 546 0.685E-03 0.108E-03
DAV: 20 -0.594556478147E+02 -0.10833E-04 -0.77882E-07 475 0.336E-03 0.494E-04
DAV: 21 -0.594556559770E+02 -0.81623E-05 -0.65349E-07 493 0.298E-03
1 F= -.59455656E+02 E0= -.59459522E+02 d E =0.115985E-01