./iterations/neb0_image01_iter26_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 0.150942900386E+04 0.15094E+04 -0.43514E+04 322 0.697E+02
DAV: 2 0.252911294331E+03 -0.12565E+04 -0.11787E+04 428 0.164E+02
DAV: 3 -0.355145917510E+03 -0.60806E+03 -0.60421E+03 348 0.118E+02
DAV: 4 -0.433253837914E+03 -0.78108E+02 -0.77782E+02 316 0.535E+01
DAV: 5 -0.435094722624E+03 -0.18409E+01 -0.18379E+01 340 0.827E+00 0.426E+01
DAV: 6 -0.389197374049E+03 0.45897E+02 -0.14912E+02 308 0.287E+01 0.208E+01
DAV: 7 -0.385738815384E+03 0.34586E+01 -0.12487E+01 340 0.775E+00 0.104E+01
DAV: 8 -0.384313882346E+03 0.14249E+01 -0.19157E+00 332 0.370E+00 0.424E+00
DAV: 9 -0.383782879080E+03 0.53100E+00 -0.14932E+00 332 0.216E+00 0.104E+00
DAV: 10 -0.383727826983E+03 0.55052E-01 -0.10464E-01 332 0.903E-01 0.778E-01
DAV: 11 -0.383690139208E+03 0.37688E-01 -0.76089E-02 332 0.712E-01 0.480E-01
DAV: 12 -0.383673773279E+03 0.16366E-01 -0.45978E-02 364 0.522E-01 0.602E-01
DAV: 13 -0.383666949696E+03 0.68236E-02 -0.50738E-02 372 0.317E-01 0.370E-01
DAV: 14 -0.383668225382E+03 -0.12757E-02 -0.62570E-02 316 0.361E-01 0.750E-01
DAV: 15 -0.383663173127E+03 0.50523E-02 -0.63047E-02 300 0.230E-01 0.263E-01
DAV: 16 -0.383669473138E+03 -0.63000E-02 -0.11028E-02 292 0.349E-01 0.247E-01
DAV: 17 -0.383674576097E+03 -0.51030E-02 -0.67791E-03 332 0.186E-01 0.258E-01
DAV: 18 -0.383682765850E+03 -0.81898E-02 -0.27215E-03 284 0.124E-01 0.207E-01
DAV: 19 -0.383695729535E+03 -0.12964E-01 -0.51960E-03 300 0.163E-01 0.576E-02
DAV: 20 -0.383702015468E+03 -0.62859E-02 -0.12743E-03 324 0.964E-02 0.608E-02
DAV: 21 -0.383705416693E+03 -0.34012E-02 -0.33392E-04 316 0.459E-02 0.495E-02
DAV: 22 -0.383709033468E+03 -0.36168E-02 -0.14686E-04 308 0.247E-02 0.447E-02
DAV: 23 -0.383712802759E+03 -0.37693E-02 -0.18499E-04 300 0.283E-02 0.197E-02
DAV: 24 -0.383714730651E+03 -0.19279E-02 -0.13162E-04 300 0.234E-02 0.172E-02
DAV: 25 -0.383715534393E+03 -0.80374E-03 -0.30427E-05 268 0.121E-02 0.124E-02
DAV: 26 -0.383715933609E+03 -0.39922E-03 -0.24309E-05 236 0.110E-02 0.452E-03
DAV: 27 -0.383716173239E+03 -0.23963E-03 -0.91565E-06 228 0.677E-03 0.403E-03
DAV: 28 -0.383716332861E+03 -0.15962E-03 -0.61944E-06 228 0.464E-03 0.202E-03
DAV: 29 -0.383716414101E+03 -0.81240E-04 -0.35637E-06 228 0.365E-03 0.177E-03
DAV: 30 -0.383716431733E+03 -0.17632E-04 -0.84388E-07 236 0.223E-03 0.157E-03
DAV: 31 -0.383716462776E+03 -0.31043E-04 -0.13412E-06 204 0.274E-03 0.174E-03
DAV: 32 -0.383716468859E+03 -0.60836E-05 -0.39442E-07 236 0.169E-03
1 F= -.38371647E+03 E0= -.38372978E+03 d E =0.399324E-01