./iterations/neb0_image01_iter10_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 0.800057268390E+03 0.80006E+03 -0.25753E+04 896 0.101E+03
DAV: 2 0.106768781160E+03 -0.69329E+03 -0.67630E+03 1136 0.280E+02
DAV: 3 -0.598850384038E+02 -0.16665E+03 -0.16617E+03 822 0.154E+02
DAV: 4 -0.648698526958E+02 -0.49848E+01 -0.49656E+01 899 0.294E+01
DAV: 5 -0.649304054512E+02 -0.60553E-01 -0.60363E-01 849 0.326E+00 0.202E+01
DAV: 6 -0.598525856206E+02 0.50778E+01 -0.17749E+01 808 0.218E+01 0.107E+01
DAV: 7 -0.595895306326E+02 0.26305E+00 -0.10340E+00 894 0.552E+00 0.415E+00
DAV: 8 -0.595778272221E+02 0.11703E-01 -0.14696E-01 864 0.232E+00 0.129E+00
DAV: 9 -0.595868505726E+02 -0.90234E-02 -0.20287E-02 928 0.132E+00 0.354E-01
DAV: 10 -0.595887471441E+02 -0.18966E-02 -0.47719E-03 849 0.380E-01 0.196E-01
DAV: 11 -0.595904237626E+02 -0.16766E-02 -0.13516E-03 785 0.248E-01 0.719E-02
DAV: 12 -0.595917611033E+02 -0.13373E-02 -0.23470E-04 849 0.120E-01 0.270E-02
DAV: 13 -0.595930401666E+02 -0.12791E-02 -0.14714E-04 834 0.614E-02 0.224E-02
DAV: 14 -0.595936569170E+02 -0.61675E-03 -0.50968E-05 780 0.357E-02 0.957E-03
DAV: 15 -0.595941312801E+02 -0.47436E-03 -0.49108E-05 775 0.342E-02 0.660E-03
DAV: 16 -0.595942574208E+02 -0.12614E-03 -0.97603E-06 598 0.154E-02 0.385E-03
DAV: 17 -0.595943590279E+02 -0.10161E-03 -0.65708E-06 578 0.112E-02 0.240E-03
DAV: 18 -0.595944218830E+02 -0.62855E-04 -0.39025E-06 565 0.765E-03 0.108E-03
DAV: 19 -0.595944527592E+02 -0.30876E-04 -0.19259E-06 535 0.523E-03 0.105E-03
DAV: 20 -0.595944646483E+02 -0.11889E-04 -0.66837E-07 460 0.320E-03 0.428E-04
DAV: 21 -0.595944696870E+02 -0.50387E-05 -0.40255E-07 479 0.230E-03
1 F= -.59594470E+02 E0= -.59598335E+02 d E =0.115964E-01