iterations/neb0_image07_iter16_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 0.145237979614E+04 0.14524E+04 -0.44244E+04 330 0.697E+02
DAV: 2 0.228878503666E+03 -0.12235E+04 -0.11475E+04 426 0.163E+02
DAV: 3 -0.361256728785E+03 -0.59014E+03 -0.58671E+03 345 0.114E+02
DAV: 4 -0.432969845823E+03 -0.71713E+02 -0.71449E+02 318 0.512E+01
DAV: 5 -0.434590337698E+03 -0.16205E+01 -0.16178E+01 318 0.792E+00 0.427E+01
DAV: 6 -0.388739671922E+03 0.45851E+02 -0.14743E+02 309 0.286E+01 0.208E+01
DAV: 7 -0.385270687618E+03 0.34690E+01 -0.13176E+01 345 0.782E+00 0.104E+01
DAV: 8 -0.383832454421E+03 0.14382E+01 -0.26081E+00 345 0.396E+00 0.434E+00
DAV: 9 -0.383288897538E+03 0.54356E+00 -0.10608E+00 336 0.224E+00 0.132E+00
DAV: 10 -0.383208626850E+03 0.80271E-01 -0.33022E-01 345 0.125E+00 0.103E+00
DAV: 11 -0.383185809787E+03 0.22817E-01 -0.11887E-01 336 0.692E-01 0.733E-01
DAV: 12 -0.383162466908E+03 0.23343E-01 -0.82093E-02 309 0.503E-01 0.747E-01
DAV: 13 -0.383155699619E+03 0.67673E-02 -0.15128E-01 372 0.458E-01 0.743E-01
DAV: 14 -0.383139318451E+03 0.16381E-01 -0.37895E-02 327 0.485E-01 0.424E-01
DAV: 15 -0.383138556653E+03 0.76180E-03 -0.43146E-02 327 0.381E-01 0.293E-01
DAV: 16 -0.383145457514E+03 -0.69009E-02 -0.12262E-02 291 0.249E-01 0.237E-01
DAV: 17 -0.383151871479E+03 -0.64140E-02 -0.39450E-03 327 0.188E-01 0.144E-01
DAV: 18 -0.383160223453E+03 -0.83520E-02 -0.34886E-03 309 0.143E-01 0.104E-01
DAV: 19 -0.383169719552E+03 -0.94961E-02 -0.15955E-03 318 0.115E-01 0.524E-02
DAV: 20 -0.383175586223E+03 -0.58667E-02 -0.64345E-04 327 0.724E-02 0.377E-02
DAV: 21 -0.383182577725E+03 -0.69915E-02 -0.45731E-04 309 0.500E-02 0.260E-02
DAV: 22 -0.383187137810E+03 -0.45601E-02 -0.22717E-04 327 0.307E-02 0.244E-02
DAV: 23 -0.383188830218E+03 -0.16924E-02 -0.97283E-05 327 0.242E-02 0.189E-02
DAV: 24 -0.383190799378E+03 -0.19692E-02 -0.10665E-04 273 0.190E-02 0.715E-03
DAV: 25 -0.383191400871E+03 -0.60149E-03 -0.25496E-05 255 0.104E-02 0.766E-03
DAV: 26 -0.383191808102E+03 -0.40723E-03 -0.14164E-05 210 0.810E-03 0.696E-03
DAV: 27 -0.383192000213E+03 -0.19211E-03 -0.81179E-06 219 0.518E-03 0.263E-03
DAV: 28 -0.383192151880E+03 -0.15167E-03 -0.58998E-06 210 0.598E-03 0.303E-03
DAV: 29 -0.383192194191E+03 -0.42311E-04 -0.29006E-06 228 0.368E-03 0.306E-03
DAV: 30 -0.383192214164E+03 -0.19973E-04 -0.10279E-06 201 0.220E-03 0.263E-03
DAV: 31 -0.383192238780E+03 -0.24616E-04 -0.17080E-06 201 0.336E-03 0.938E-04
DAV: 32 -0.383192244550E+03 -0.57701E-05 -0.46212E-07 228 0.171E-03
1 F= -.38319224E+03 E0= -.38320903E+03 d E =0.503689E-01