iterations/neb0_image05_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 0.144973992492E+04 0.14497E+04 -0.44209E+04 330 0.697E+02
DAV: 2 0.232119570879E+03 -0.12176E+04 -0.11424E+04 417 0.163E+02
DAV: 3 -0.361114093096E+03 -0.59323E+03 -0.59003E+03 345 0.114E+02
DAV: 4 -0.433138684884E+03 -0.72025E+02 -0.71779E+02 309 0.515E+01
DAV: 5 -0.434787271812E+03 -0.16486E+01 -0.16458E+01 318 0.797E+00 0.426E+01
DAV: 6 -0.388975302035E+03 0.45812E+02 -0.14708E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385529928133E+03 0.34454E+01 -0.13381E+01 345 0.779E+00 0.104E+01
DAV: 8 -0.384059425048E+03 0.14705E+01 -0.19881E+00 336 0.382E+00 0.430E+00
DAV: 9 -0.383518700573E+03 0.54072E+00 -0.63499E-01 336 0.214E+00 0.110E+00
DAV: 10 -0.383438483069E+03 0.80218E-01 -0.12687E-01 327 0.983E-01 0.764E-01
DAV: 11 -0.383413414257E+03 0.25069E-01 -0.44180E-02 336 0.587E-01 0.692E-01
DAV: 12 -0.383398539004E+03 0.14875E-01 -0.63201E-02 345 0.422E-01 0.500E-01
DAV: 13 -0.383384662331E+03 0.13877E-01 -0.14634E-02 318 0.376E-01 0.356E-01
DAV: 14 -0.383380859835E+03 0.38025E-02 -0.54265E-02 327 0.403E-01 0.449E-01
DAV: 15 -0.383380766084E+03 0.93751E-04 -0.15074E-02 318 0.253E-01 0.256E-01
DAV: 16 -0.383386631613E+03 -0.58655E-02 -0.43983E-03 309 0.199E-01 0.167E-01
DAV: 17 -0.383397701529E+03 -0.11070E-01 -0.48155E-03 291 0.206E-01 0.115E-01
DAV: 18 -0.383406166608E+03 -0.84651E-02 -0.28208E-03 318 0.145E-01 0.103E-01
DAV: 19 -0.383413339207E+03 -0.71726E-02 -0.94375E-04 345 0.916E-02 0.479E-02
DAV: 20 -0.383422725650E+03 -0.93864E-02 -0.68088E-04 291 0.566E-02 0.613E-02
DAV: 21 -0.383427470228E+03 -0.47446E-02 -0.30199E-04 327 0.357E-02 0.273E-02
DAV: 22 -0.383431018013E+03 -0.35478E-02 -0.27443E-04 318 0.359E-02 0.207E-02
DAV: 23 -0.383433108154E+03 -0.20901E-02 -0.99723E-05 318 0.203E-02 0.159E-02
DAV: 24 -0.383433772726E+03 -0.66457E-03 -0.26392E-05 273 0.129E-02 0.108E-02
DAV: 25 -0.383434271051E+03 -0.49832E-03 -0.23271E-05 228 0.104E-02 0.499E-03
DAV: 26 -0.383434496312E+03 -0.22526E-03 -0.69885E-06 228 0.613E-03 0.323E-03
DAV: 27 -0.383434695034E+03 -0.19872E-03 -0.53652E-06 201 0.454E-03 0.256E-03
DAV: 28 -0.383434799264E+03 -0.10423E-03 -0.39190E-06 228 0.398E-03 0.207E-03
DAV: 29 -0.383434835511E+03 -0.36247E-04 -0.13981E-06 228 0.258E-03 0.119E-03
DAV: 30 -0.383434865210E+03 -0.29699E-04 -0.15423E-06 210 0.292E-03 0.113E-03
DAV: 31 -0.383434872043E+03 -0.68331E-05 -0.46996E-07 228 0.152E-03
1 F= -.38343487E+03 E0= -.38345164E+03 d E =0.503107E-01