./iterations/neb0_image08_iter49_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 0.793410228614E+03 0.79341E+03 -0.26015E+04 920 0.101E+03
DAV: 2 0.100372638754E+03 -0.69304E+03 -0.67599E+03 1120 0.281E+02
DAV: 3 -0.631730336877E+02 -0.16355E+03 -0.16323E+03 815 0.154E+02
DAV: 4 -0.678501697678E+02 -0.46771E+01 -0.46665E+01 920 0.288E+01
DAV: 5 -0.679024750288E+02 -0.52305E-01 -0.52134E-01 894 0.310E+00 0.196E+01
DAV: 6 -0.632599047874E+02 0.46426E+01 -0.18818E+01 894 0.224E+01 0.108E+01
DAV: 7 -0.631067795433E+02 0.15313E+00 -0.96868E-01 920 0.575E+00 0.397E+00
DAV: 8 -0.631003655059E+02 0.64140E-02 -0.94924E-02 920 0.210E+00 0.138E+00
DAV: 9 -0.631090413629E+02 -0.86759E-02 -0.20104E-02 928 0.104E+00 0.331E-01
DAV: 10 -0.631102029716E+02 -0.11616E-02 -0.57178E-03 923 0.626E-01 0.174E-01
DAV: 11 -0.631109422347E+02 -0.73926E-03 -0.78879E-04 872 0.209E-01 0.757E-02
DAV: 12 -0.631119615342E+02 -0.10193E-02 -0.32594E-04 902 0.158E-01 0.309E-02
DAV: 13 -0.631129280191E+02 -0.96648E-03 -0.20528E-04 843 0.146E-01 0.373E-02
DAV: 14 -0.631138236342E+02 -0.89562E-03 -0.24195E-04 804 0.123E-01 0.171E-02
DAV: 15 -0.631142398103E+02 -0.41618E-03 -0.47753E-05 859 0.445E-02 0.861E-03
DAV: 16 -0.631144974809E+02 -0.25767E-03 -0.18217E-05 628 0.263E-02 0.522E-03
DAV: 17 -0.631146679598E+02 -0.17048E-03 -0.10364E-05 662 0.166E-02 0.308E-03
DAV: 18 -0.631147782756E+02 -0.11032E-03 -0.86996E-06 620 0.114E-02 0.229E-03
DAV: 19 -0.631148064451E+02 -0.28169E-04 -0.21570E-06 627 0.887E-03 0.112E-03
DAV: 20 -0.631148260125E+02 -0.19567E-04 -0.13074E-06 596 0.508E-03 0.112E-03
DAV: 21 -0.631148315243E+02 -0.55118E-05 -0.35780E-07 518 0.354E-03
1 F= -.63114832E+02 E0= -.63118697E+02 d E =0.115964E-01