iterations/neb0_image08_iter43_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 0.143265709068E+04 0.14327E+04 -0.44124E+04 330 0.697E+02
DAV: 2 0.233174793531E+03 -0.11995E+04 -0.11253E+04 417 0.162E+02
DAV: 3 -0.342687828402E+03 -0.57586E+03 -0.57103E+03 345 0.113E+02
DAV: 4 -0.418812848114E+03 -0.76125E+02 -0.75563E+02 318 0.510E+01
DAV: 5 -0.420796846498E+03 -0.19840E+01 -0.19775E+01 318 0.832E+00 0.416E+01
DAV: 6 -0.377521805928E+03 0.43275E+02 -0.14409E+02 309 0.280E+01 0.203E+01
DAV: 7 -0.374350162105E+03 0.31716E+01 -0.11992E+01 336 0.807E+00 0.101E+01
DAV: 8 -0.372953746672E+03 0.13964E+01 -0.17890E+00 327 0.390E+00 0.427E+00
DAV: 9 -0.372418886461E+03 0.53486E+00 -0.68626E-01 318 0.201E+00 0.975E-01
DAV: 10 -0.372363388497E+03 0.55498E-01 -0.10910E-01 354 0.940E-01 0.678E-01
DAV: 11 -0.372331815708E+03 0.31573E-01 -0.22893E-02 327 0.443E-01 0.399E-01
DAV: 12 -0.372308944857E+03 0.22871E-01 -0.14885E-02 327 0.374E-01 0.214E-01
DAV: 13 -0.372305445970E+03 0.34989E-02 -0.17362E-02 327 0.437E-01 0.145E-01
DAV: 14 -0.372315772197E+03 -0.10326E-01 -0.75357E-03 309 0.272E-01 0.109E-01
DAV: 15 -0.372326730376E+03 -0.10958E-01 -0.29506E-03 318 0.153E-01 0.597E-02
DAV: 16 -0.372335143514E+03 -0.84131E-02 -0.17825E-03 309 0.124E-01 0.441E-02
DAV: 17 -0.372343890889E+03 -0.87474E-02 -0.10780E-03 327 0.865E-02 0.372E-02
DAV: 18 -0.372350865332E+03 -0.69744E-02 -0.35251E-04 336 0.387E-02 0.226E-02
DAV: 19 -0.372355162415E+03 -0.42971E-02 -0.23862E-04 309 0.307E-02 0.121E-02
DAV: 20 -0.372357897773E+03 -0.27354E-02 -0.16445E-04 318 0.246E-02 0.104E-02
DAV: 21 -0.372358752648E+03 -0.85487E-03 -0.24852E-05 273 0.119E-02 0.656E-03
DAV: 22 -0.372359504734E+03 -0.75209E-03 -0.41804E-05 282 0.134E-02 0.597E-03
DAV: 23 -0.372359737083E+03 -0.23235E-03 -0.50549E-06 219 0.714E-03 0.338E-03
DAV: 24 -0.372359917626E+03 -0.18054E-03 -0.98622E-06 210 0.775E-03 0.234E-03
DAV: 25 -0.372359997191E+03 -0.79565E-04 -0.23932E-06 219 0.370E-03 0.164E-03
DAV: 26 -0.372360056601E+03 -0.59409E-04 -0.26165E-06 201 0.346E-03 0.753E-04
DAV: 27 -0.372360078298E+03 -0.21698E-04 -0.10738E-06 219 0.205E-03 0.626E-04
DAV: 28 -0.372360090006E+03 -0.11708E-04 -0.58723E-07 219 0.138E-03 0.433E-04
DAV: 29 -0.372360096329E+03 -0.63228E-05 -0.30205E-07 219 0.945E-04
1 F= -.37236010E+03 E0= -.37236396E+03 d E =0.115976E-01