./neb0_image09_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 0.797430333647E+03 0.79743E+03 -0.25971E+04 912 0.101E+03
DAV: 2 0.101845402382E+03 -0.69558E+03 -0.67869E+03 1096 0.282E+02
DAV: 3 -0.635010470850E+02 -0.16535E+03 -0.16500E+03 827 0.155E+02
DAV: 4 -0.681409880131E+02 -0.46399E+01 -0.46242E+01 896 0.292E+01
DAV: 5 -0.681998370029E+02 -0.58849E-01 -0.58690E-01 920 0.320E+00 0.198E+01
DAV: 6 -0.636292333806E+02 0.45706E+01 -0.18799E+01 838 0.216E+01 0.109E+01
DAV: 7 -0.634821682412E+02 0.14707E+00 -0.91309E-01 971 0.523E+00 0.398E+00
DAV: 8 -0.634806627940E+02 0.15054E-02 -0.89124E-02 875 0.197E+00 0.136E+00
DAV: 9 -0.634913696452E+02 -0.10707E-01 -0.17467E-02 923 0.870E-01 0.318E-01
DAV: 10 -0.634935384166E+02 -0.21688E-02 -0.41893E-03 923 0.448E-01 0.152E-01
DAV: 11 -0.634945023550E+02 -0.96394E-03 -0.49854E-04 859 0.160E-01 0.722E-02
DAV: 12 -0.634959469752E+02 -0.14446E-02 -0.33701E-04 849 0.130E-01 0.336E-02
DAV: 13 -0.634968348308E+02 -0.88786E-03 -0.13369E-04 843 0.775E-02 0.305E-02
DAV: 14 -0.634975001415E+02 -0.66531E-03 -0.78126E-05 820 0.498E-02 0.124E-02
DAV: 15 -0.634977846134E+02 -0.28447E-03 -0.24323E-05 699 0.332E-02 0.556E-03
DAV: 16 -0.634979837172E+02 -0.19910E-03 -0.15658E-05 607 0.203E-02 0.415E-03
DAV: 17 -0.634981081269E+02 -0.12441E-03 -0.71167E-06 633 0.119E-02 0.253E-03
DAV: 18 -0.634981652462E+02 -0.57119E-04 -0.30539E-06 646 0.645E-03 0.113E-03
DAV: 19 -0.634981948339E+02 -0.29588E-04 -0.17358E-06 614 0.585E-03 0.123E-03
DAV: 20 -0.634982021677E+02 -0.73338E-05 -0.44850E-07 566 0.281E-03
1 F= -.63498202E+02 E0= -.63502068E+02 d E =0.115965E-01