./iterations/neb0_image04_iter15_OSZICAR.out output for 42: 3.3A-->1.3A 712(amd-3) Si-CH3H...HO-Si two dimer closed (TSS for CH3...OH)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.151102680699E+04 0.15110E+04 -0.43532E+04 322 0.697E+02
DAV: 2 0.253972424717E+03 -0.12571E+04 -0.11801E+04 428 0.164E+02
DAV: 3 -0.354344765296E+03 -0.60832E+03 -0.60465E+03 348 0.118E+02
DAV: 4 -0.433081061186E+03 -0.78736E+02 -0.78394E+02 316 0.535E+01
DAV: 5 -0.434938340865E+03 -0.18573E+01 -0.18540E+01 340 0.831E+00 0.426E+01
DAV: 6 -0.389150305072E+03 0.45788E+02 -0.14849E+02 308 0.286E+01 0.208E+01
DAV: 7 -0.385695856756E+03 0.34544E+01 -0.12597E+01 340 0.780E+00 0.104E+01
DAV: 8 -0.384283917185E+03 0.14119E+01 -0.20666E+00 332 0.376E+00 0.422E+00
DAV: 9 -0.383714455988E+03 0.56946E+00 -0.70222E-01 332 0.199E+00 0.109E+00
DAV: 10 -0.383677593789E+03 0.36862E-01 -0.39320E-01 348 0.968E-01 0.786E-01
DAV: 11 -0.383647128084E+03 0.30466E-01 -0.22164E-02 316 0.456E-01 0.611E-01
DAV: 12 -0.383632367250E+03 0.14761E-01 -0.16488E-01 348 0.620E-01 0.657E-01
DAV: 13 -0.383617009153E+03 0.15358E-01 -0.54900E-02 308 0.453E-01 0.395E-01
DAV: 14 -0.383615498999E+03 0.15102E-02 -0.25824E-02 324 0.316E-01 0.409E-01
DAV: 15 -0.383617609955E+03 -0.21110E-02 -0.32903E-02 348 0.313E-01 0.340E-01
DAV: 16 -0.383620695274E+03 -0.30853E-02 -0.58774E-03 324 0.181E-01 0.165E-01
DAV: 17 -0.383629998555E+03 -0.93033E-02 -0.41623E-03 300 0.201E-01 0.102E-01
DAV: 18 -0.383642528566E+03 -0.12530E-01 -0.48816E-03 316 0.194E-01 0.954E-02
DAV: 19 -0.383652390028E+03 -0.98615E-02 -0.23092E-03 324 0.139E-01 0.438E-02
DAV: 20 -0.383659173928E+03 -0.67839E-02 -0.58446E-04 316 0.644E-02 0.527E-02
DAV: 21 -0.383662585884E+03 -0.34120E-02 -0.15067E-04 316 0.283E-02 0.317E-02
DAV: 22 -0.383666545897E+03 -0.39600E-02 -0.25355E-04 300 0.302E-02 0.155E-02
DAV: 23 -0.383668284375E+03 -0.17385E-02 -0.11738E-04 308 0.209E-02 0.148E-02
DAV: 24 -0.383669062649E+03 -0.77827E-03 -0.26887E-05 260 0.112E-02 0.561E-03
DAV: 25 -0.383669527224E+03 -0.46458E-03 -0.20799E-05 244 0.887E-03 0.562E-03
DAV: 26 -0.383669739758E+03 -0.21253E-03 -0.76894E-06 228 0.610E-03 0.229E-03
DAV: 27 -0.383669843199E+03 -0.10344E-03 -0.53639E-06 212 0.496E-03 0.246E-03
DAV: 28 -0.383669900582E+03 -0.57384E-04 -0.23785E-06 228 0.344E-03 0.122E-03
DAV: 29 -0.383669926602E+03 -0.26020E-04 -0.14668E-06 212 0.256E-03 0.777E-04
DAV: 30 -0.383669940618E+03 -0.14016E-04 -0.77382E-07 228 0.209E-03 0.975E-04
DAV: 31 -0.383669946124E+03 -0.55060E-05 -0.40790E-07 204 0.141E-03
1 F= -.38366995E+03 E0= -.38368414E+03 d E =0.425821E-01