iterations/neb0_image09_iter10_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 0.145376133179E+04 0.14538E+04 -0.44277E+04 330 0.697E+02
DAV: 2 0.231903008537E+03 -0.12219E+04 -0.11459E+04 426 0.163E+02
DAV: 3 -0.359513031380E+03 -0.59142E+03 -0.58807E+03 345 0.114E+02
DAV: 4 -0.432218780329E+03 -0.72706E+02 -0.72410E+02 318 0.514E+01
DAV: 5 -0.433873770689E+03 -0.16550E+01 -0.16519E+01 318 0.801E+00 0.428E+01
DAV: 6 -0.388010533721E+03 0.45863E+02 -0.14741E+02 309 0.286E+01 0.209E+01
DAV: 7 -0.384534291904E+03 0.34762E+01 -0.13148E+01 336 0.789E+00 0.104E+01
DAV: 8 -0.383077696661E+03 0.14566E+01 -0.20107E+00 345 0.392E+00 0.431E+00
DAV: 9 -0.382538203557E+03 0.53949E+00 -0.80774E-01 336 0.206E+00 0.100E+00
DAV: 10 -0.382470738006E+03 0.67466E-01 -0.11152E-01 336 0.903E-01 0.983E-01
DAV: 11 -0.382453806658E+03 0.16931E-01 -0.13493E-01 372 0.553E-01 0.841E-01
DAV: 12 -0.382430736358E+03 0.23070E-01 -0.23504E-02 327 0.419E-01 0.821E-01
DAV: 13 -0.382416458150E+03 0.14278E-01 -0.27224E-02 354 0.424E-01 0.614E-01
DAV: 14 -0.382405547911E+03 0.10910E-01 -0.85004E-02 327 0.499E-01 0.644E-01
DAV: 15 -0.382401588025E+03 0.39599E-02 -0.31540E-02 318 0.276E-01 0.254E-01
DAV: 16 -0.382407438579E+03 -0.58506E-02 -0.66768E-03 300 0.217E-01 0.147E-01
DAV: 17 -0.382415033031E+03 -0.75945E-02 -0.27352E-03 318 0.173E-01 0.147E-01
DAV: 18 -0.382426027239E+03 -0.10994E-01 -0.44909E-03 300 0.210E-01 0.140E-01
DAV: 19 -0.382435921150E+03 -0.98939E-02 -0.27274E-03 318 0.160E-01 0.985E-02
DAV: 20 -0.382440554678E+03 -0.46335E-02 -0.71115E-04 336 0.678E-02 0.962E-02
DAV: 21 -0.382445563690E+03 -0.50090E-02 -0.31052E-04 309 0.428E-02 0.698E-02
DAV: 22 -0.382450335114E+03 -0.47714E-02 -0.42288E-04 336 0.473E-02 0.427E-02
DAV: 23 -0.382453857025E+03 -0.35219E-02 -0.20887E-04 300 0.332E-02 0.302E-02
DAV: 24 -0.382455177030E+03 -0.13200E-02 -0.60608E-05 309 0.155E-02 0.254E-02
DAV: 25 -0.382456025263E+03 -0.84823E-03 -0.45695E-05 282 0.131E-02 0.793E-03
DAV: 26 -0.382456620033E+03 -0.59477E-03 -0.19796E-05 255 0.916E-03 0.536E-03
DAV: 27 -0.382456955810E+03 -0.33578E-03 -0.11984E-05 210 0.797E-03 0.656E-03
DAV: 28 -0.382457178156E+03 -0.22235E-03 -0.95538E-06 219 0.661E-03 0.547E-03
DAV: 29 -0.382457245208E+03 -0.67052E-04 -0.34504E-06 228 0.471E-03 0.213E-03
DAV: 30 -0.382457289185E+03 -0.43977E-04 -0.32163E-06 192 0.473E-03 0.184E-03
DAV: 31 -0.382457311722E+03 -0.22537E-04 -0.11345E-06 228 0.235E-03 0.162E-03
DAV: 32 -0.382457327060E+03 -0.15338E-04 -0.58919E-07 192 0.196E-03 0.885E-04
DAV: 33 -0.382457345289E+03 -0.18229E-04 -0.96762E-07 210 0.238E-03 0.126E-03
DAV: 34 -0.382457349802E+03 -0.45128E-05 -0.28324E-07 228 0.140E-03
1 F= -.38245735E+03 E0= -.38247398E+03 d E =0.498938E-01