./iterations/neb0_image09_iter92_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 0.797602941795E+03 0.79760E+03 -0.25971E+04 912 0.101E+03
DAV: 2 0.102008475697E+03 -0.69559E+03 -0.67865E+03 1096 0.282E+02
DAV: 3 -0.634815666857E+02 -0.16549E+03 -0.16513E+03 827 0.155E+02
DAV: 4 -0.681370722036E+02 -0.46555E+01 -0.46385E+01 888 0.292E+01
DAV: 5 -0.681969810158E+02 -0.59909E-01 -0.59753E-01 915 0.323E+00 0.198E+01
DAV: 6 -0.636272369869E+02 0.45697E+01 -0.18796E+01 854 0.216E+01 0.109E+01
DAV: 7 -0.634788700303E+02 0.14837E+00 -0.90516E-01 971 0.522E+00 0.398E+00
DAV: 8 -0.634770236900E+02 0.18463E-02 -0.88989E-02 875 0.197E+00 0.136E+00
DAV: 9 -0.634875635423E+02 -0.10540E-01 -0.17544E-02 923 0.889E-01 0.319E-01
DAV: 10 -0.634897166196E+02 -0.21531E-02 -0.43565E-03 918 0.457E-01 0.152E-01
DAV: 11 -0.634906662434E+02 -0.94962E-03 -0.51878E-04 864 0.164E-01 0.738E-02
DAV: 12 -0.634921153482E+02 -0.14491E-02 -0.34581E-04 844 0.130E-01 0.344E-02
DAV: 13 -0.634930018669E+02 -0.88652E-03 -0.13429E-04 843 0.807E-02 0.314E-02
DAV: 14 -0.634936899223E+02 -0.68806E-03 -0.97286E-05 799 0.583E-02 0.137E-02
DAV: 15 -0.634939818519E+02 -0.29193E-03 -0.27094E-05 758 0.343E-02 0.587E-03
DAV: 16 -0.634941904244E+02 -0.20857E-03 -0.14142E-05 615 0.199E-02 0.431E-03
DAV: 17 -0.634943207181E+02 -0.13029E-03 -0.73860E-06 633 0.121E-02 0.254E-03
DAV: 18 -0.634943783928E+02 -0.57675E-04 -0.31362E-06 646 0.657E-03 0.115E-03
DAV: 19 -0.634944132144E+02 -0.34822E-04 -0.20673E-06 594 0.642E-03 0.121E-03
DAV: 20 -0.634944183366E+02 -0.51222E-05 -0.42958E-07 491 0.283E-03
1 F= -.63494418E+02 E0= -.63498284E+02 d E =0.115965E-01