iterations/neb0_image09_iter29_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 0.144950458190E+04 0.14495E+04 -0.44243E+04 330 0.697E+02
DAV: 2 0.229726760376E+03 -0.12198E+04 -0.11454E+04 426 0.163E+02
DAV: 3 -0.361808225364E+03 -0.59153E+03 -0.58689E+03 354 0.114E+02
DAV: 4 -0.432424413426E+03 -0.70616E+02 -0.70356E+02 318 0.496E+01
DAV: 5 -0.434015787804E+03 -0.15914E+01 -0.15885E+01 327 0.777E+00 0.426E+01
DAV: 6 -0.388423695512E+03 0.45592E+02 -0.14845E+02 309 0.287E+01 0.208E+01
DAV: 7 -0.385026081378E+03 0.33976E+01 -0.12594E+01 345 0.773E+00 0.104E+01
DAV: 8 -0.383585913474E+03 0.14402E+01 -0.23043E+00 336 0.384E+00 0.432E+00
DAV: 9 -0.383024868917E+03 0.56104E+00 -0.90931E-01 336 0.223E+00 0.108E+00
DAV: 10 -0.382950335474E+03 0.74533E-01 -0.13082E-01 327 0.994E-01 0.906E-01
DAV: 11 -0.382940494841E+03 0.98406E-02 -0.21065E-01 363 0.792E-01 0.102E+00
DAV: 12 -0.382908541279E+03 0.31954E-01 -0.14826E-01 381 0.616E-01 0.525E-01
DAV: 13 -0.382891716500E+03 0.16825E-01 -0.25119E-02 327 0.453E-01 0.345E-01
DAV: 14 -0.382883840005E+03 0.78765E-02 -0.14211E-02 309 0.373E-01 0.294E-01
DAV: 15 -0.382888012377E+03 -0.41724E-02 -0.64047E-03 336 0.254E-01 0.153E-01
DAV: 16 -0.382896899789E+03 -0.88874E-02 -0.25545E-03 300 0.191E-01 0.986E-02
DAV: 17 -0.382906516223E+03 -0.96164E-02 -0.30735E-03 318 0.180E-01 0.963E-02
DAV: 18 -0.382915250698E+03 -0.87345E-02 -0.20285E-03 309 0.143E-01 0.785E-02
DAV: 19 -0.382922453434E+03 -0.72027E-02 -0.79466E-04 327 0.832E-02 0.799E-02
DAV: 20 -0.382927403633E+03 -0.49502E-02 -0.27479E-04 309 0.412E-02 0.549E-02
DAV: 21 -0.382932753624E+03 -0.53500E-02 -0.51931E-04 309 0.533E-02 0.239E-02
DAV: 22 -0.382935050337E+03 -0.22967E-02 -0.11109E-04 354 0.243E-02 0.342E-02
DAV: 23 -0.382937028820E+03 -0.19785E-02 -0.10257E-04 291 0.218E-02 0.197E-02
DAV: 24 -0.382938010156E+03 -0.98134E-03 -0.42050E-05 300 0.127E-02 0.109E-02
DAV: 25 -0.382938597835E+03 -0.58768E-03 -0.16255E-05 228 0.869E-03 0.472E-03
DAV: 26 -0.382938993145E+03 -0.39531E-03 -0.13845E-05 228 0.723E-03 0.330E-03
DAV: 27 -0.382939151553E+03 -0.15841E-03 -0.52793E-06 219 0.503E-03 0.323E-03
DAV: 28 -0.382939246255E+03 -0.94703E-04 -0.35583E-06 201 0.355E-03 0.194E-03
DAV: 29 -0.382939279094E+03 -0.32839E-04 -0.15483E-06 219 0.269E-03 0.105E-03
DAV: 30 -0.382939316846E+03 -0.37752E-04 -0.20304E-06 192 0.327E-03 0.109E-03
DAV: 31 -0.382939321632E+03 -0.47853E-05 -0.55576E-07 228 0.161E-03
1 F= -.38293932E+03 E0= -.38295623E+03 d E =0.507155E-01