iterations/neb0_image03_iter68_OSZICAR.out output for 3: !!! 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
terminated
N E dE d eps ncg rms rms(c)
DAV: 1 0.145040785105E+04 0.14504E+04 -0.44203E+04 330 0.697E+02
DAV: 2 0.225203704650E+03 -0.12252E+04 -0.11496E+04 435 0.163E+02
DAV: 3 -0.362794930195E+03 -0.58800E+03 -0.58429E+03 354 0.114E+02
DAV: 4 -0.433541452588E+03 -0.70747E+02 -0.70495E+02 318 0.504E+01
DAV: 5 -0.435103917043E+03 -0.15625E+01 -0.15601E+01 318 0.771E+00 0.427E+01
DAV: 6 -0.388924042663E+03 0.46180E+02 -0.14876E+02 309 0.286E+01 0.208E+01
DAV: 7 -0.385443826808E+03 0.34802E+01 -0.13484E+01 345 0.782E+00 0.104E+01
DAV: 8 -0.383970660448E+03 0.14732E+01 -0.21661E+00 336 0.383E+00 0.433E+00
DAV: 9 -0.383417595069E+03 0.55307E+00 -0.13511E+00 336 0.232E+00 0.123E+00
DAV: 10 -0.383351113473E+03 0.66482E-01 -0.26132E-01 327 0.109E+00 0.102E+00
DAV: 11 -0.383330073009E+03 0.21040E-01 -0.24649E-01 345 0.614E-01 0.933E-01
DAV: 12 -0.383316385948E+03 0.13687E-01 -0.33155E-01 345 0.768E-01 0.852E-01
DAV: 13 -0.383292503500E+03 0.23882E-01 -0.84268E-02 354 0.515E-01 0.592E-01
DAV: 14 -0.383283080892E+03 0.94226E-02 -0.18061E-02 318 0.335E-01 0.435E-01
DAV: 15 -0.383280535630E+03 0.25453E-02 -0.22321E-02 318 0.435E-01 0.354E-01
DAV: 16 -0.383283308012E+03 -0.27724E-02 -0.13381E-02 336 0.294E-01 0.287E-01
DAV: 17 -0.383288616871E+03 -0.53089E-02 -0.29357E-03 282 0.179E-01 0.105E-01
DAV: 18 -0.383300422079E+03 -0.11805E-01 -0.34748E-03 300 0.170E-01 0.165E-01
DAV: 19 -0.383310393020E+03 -0.99709E-02 -0.22270E-03 327 0.138E-01 0.855E-02
DAV: 20 -0.383319597913E+03 -0.92049E-02 -0.11165E-03 318 0.978E-02 0.915E-02
DAV: 21 -0.383322538433E+03 -0.29405E-02 -0.20040E-04 345 0.430E-02 0.537E-02
DAV: 22 -0.383325142733E+03 -0.26043E-02 -0.16349E-04 300 0.290E-02 0.219E-02
DAV: 23 -0.383329383230E+03 -0.42405E-02 -0.27005E-04 291 0.330E-02 0.158E-02
DAV: 24 -0.383330932726E+03 -0.15495E-02 -0.75166E-05 327 0.174E-02 0.258E-02
DAV: 25 -0.383331551588E+03 -0.61886E-03 -0.25868E-05 264 0.137E-02 0.229E-02
DAV: 26 -0.383332163948E+03 -0.61236E-03 -0.37845E-05 282 0.121E-02 0.781E-03
DAV: 27 -0.383332323206E+03 -0.15926E-03 -0.58671E-06 246 0.696E-03 0.516E-03
DAV: 28 -0.383332500826E+03 -0.17762E-03 -0.50134E-06 210 0.488E-03 0.558E-03
DAV: 29 -0.383332588967E+03 -0.88141E-04 -0.27364E-06 228 0.379E-03 0.176E-03
DAV: 30 -0.383332638400E+03 -0.49434E-04 -0.17649E-06 210 0.305E-03 0.225E-03
DAV: 31 -0.383332658298E+03 -0.19898E-04 -0.83878E-07 228 0.219E-03 0.971E-04
DAV: 32 -0.383332667621E+03 -0.93227E-05 -0.37068E-07 228 0.127E-03
1 F= -.38333267E+03 E0= -.38334527E+03 d E =0.377993E-01