./iterations/neb0_image08_iter18_OSZICAR.out output for 3: 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
running
N E dE d eps ncg rms rms(c)
DAV: 1 0.145267509629E+04 0.14527E+04 -0.44260E+04 330 0.697E+02
DAV: 2 0.229770468104E+03 -0.12229E+04 -0.11474E+04 426 0.163E+02
DAV: 3 -0.360596884411E+03 -0.59037E+03 -0.58686E+03 345 0.114E+02
DAV: 4 -0.432785850267E+03 -0.72189E+02 -0.71909E+02 318 0.513E+01
DAV: 5 -0.434430519310E+03 -0.16447E+01 -0.16419E+01 318 0.797E+00 0.427E+01
DAV: 6 -0.388559438428E+03 0.45871E+02 -0.14770E+02 309 0.286E+01 0.209E+01
DAV: 7 -0.385088940979E+03 0.34705E+01 -0.13057E+01 345 0.783E+00 0.104E+01
DAV: 8 -0.383627194107E+03 0.14617E+01 -0.18370E+00 345 0.383E+00 0.422E+00
DAV: 9 -0.383076991016E+03 0.55020E+00 -0.78122E-01 336 0.203E+00 0.102E+00
DAV: 10 -0.383018050104E+03 0.58941E-01 -0.18394E-01 327 0.954E-01 0.872E-01
DAV: 11 -0.382998168756E+03 0.19881E-01 -0.90434E-02 354 0.534E-01 0.628E-01
DAV: 12 -0.382972494620E+03 0.25674E-01 -0.17624E-02 327 0.387E-01 0.449E-01
DAV: 13 -0.382961858280E+03 0.10636E-01 -0.14846E-01 327 0.554E-01 0.818E-01
DAV: 14 -0.382951175510E+03 0.10683E-01 -0.52940E-02 309 0.367E-01 0.373E-01
DAV: 15 -0.382955329260E+03 -0.41538E-02 -0.93064E-03 327 0.293E-01 0.181E-01
DAV: 16 -0.382963421426E+03 -0.80922E-02 -0.47893E-03 300 0.232E-01 0.221E-01
DAV: 17 -0.382974262114E+03 -0.10841E-01 -0.41636E-03 318 0.206E-01 0.206E-01
DAV: 18 -0.382983570323E+03 -0.93082E-02 -0.40106E-03 336 0.167E-01 0.643E-02
DAV: 19 -0.382991044466E+03 -0.74741E-02 -0.10541E-03 309 0.749E-02 0.105E-01
DAV: 20 -0.382995106311E+03 -0.40618E-02 -0.38346E-04 309 0.426E-02 0.497E-02
DAV: 21 -0.383000536728E+03 -0.54304E-02 -0.37035E-04 300 0.398E-02 0.315E-02
DAV: 22 -0.383002800101E+03 -0.22634E-02 -0.90101E-05 327 0.232E-02 0.192E-02
DAV: 23 -0.383004951144E+03 -0.21510E-02 -0.11619E-04 300 0.239E-02 0.140E-02
DAV: 24 -0.383006304962E+03 -0.13538E-02 -0.76560E-05 309 0.192E-02 0.147E-02
DAV: 25 -0.383006514964E+03 -0.21000E-03 -0.13699E-05 282 0.962E-03 0.121E-02
DAV: 26 -0.383006701846E+03 -0.18688E-03 -0.43013E-06 201 0.684E-03 0.109E-02
DAV: 27 -0.383006670511E+03 0.31335E-04 -0.16344E-06 237 0.435E-03 0.102E-02
DAV: 28 -0.383006751393E+03 -0.80882E-04 -0.25494E-06 201 0.351E-03 0.110E-02
DAV: 29 -0.383007232856E+03 -0.48146E-03 -0.37364E-05 264 0.153E-02 0.895E-03
DAV: 30 -0.383007357688E+03 -0.12483E-03 -0.19957E-05 300 0.107E-02 0.874E-03
DAV: 31 -0.383007364409E+03 -0.67212E-05 -0.32708E-06 255 0.456E-03
1 F= -.38300736E+03 E0= -.38302244E+03 d E =0.452229E-01