./iterations/neb0_image05_iter18_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 0.145055637521E+04 0.14506E+04 -0.44214E+04 330 0.697E+02
DAV: 2 0.232522229804E+03 -0.12180E+04 -0.11429E+04 417 0.163E+02
DAV: 3 -0.361110927342E+03 -0.59363E+03 -0.59041E+03 345 0.114E+02
DAV: 4 -0.433183282607E+03 -0.72072E+02 -0.71828E+02 309 0.515E+01
DAV: 5 -0.434830296544E+03 -0.16470E+01 -0.16442E+01 318 0.797E+00 0.426E+01
DAV: 6 -0.388968592145E+03 0.45862E+02 -0.14717E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385512614283E+03 0.34560E+01 -0.13423E+01 345 0.780E+00 0.104E+01
DAV: 8 -0.384051497089E+03 0.14611E+01 -0.21549E+00 345 0.386E+00 0.431E+00
DAV: 9 -0.383506739030E+03 0.54476E+00 -0.12766E+00 327 0.231E+00 0.129E+00
DAV: 10 -0.383451708845E+03 0.55030E-01 -0.45812E-01 336 0.118E+00 0.983E-01
DAV: 11 -0.383412263133E+03 0.39446E-01 -0.95637E-02 336 0.638E-01 0.692E-01
DAV: 12 -0.383400690116E+03 0.11573E-01 -0.84511E-02 345 0.673E-01 0.941E-01
DAV: 13 -0.383381719630E+03 0.18970E-01 -0.14134E-01 354 0.495E-01 0.617E-01
DAV: 14 -0.383370426451E+03 0.11293E-01 -0.67804E-02 318 0.424E-01 0.332E-01
DAV: 15 -0.383369055625E+03 0.13708E-02 -0.12384E-02 309 0.375E-01 0.242E-01
DAV: 16 -0.383376018739E+03 -0.69631E-02 -0.74667E-03 327 0.241E-01 0.247E-01
DAV: 17 -0.383382546886E+03 -0.65281E-02 -0.30653E-03 327 0.164E-01 0.185E-01
DAV: 18 -0.383393772842E+03 -0.11226E-01 -0.47240E-03 300 0.156E-01 0.135E-01
DAV: 19 -0.383400300893E+03 -0.65281E-02 -0.10746E-03 327 0.968E-02 0.714E-02
DAV: 20 -0.383408884683E+03 -0.85838E-02 -0.92916E-04 336 0.898E-02 0.703E-02
DAV: 21 -0.383412739715E+03 -0.38550E-02 -0.26598E-04 327 0.403E-02 0.319E-02
DAV: 22 -0.383415381391E+03 -0.26417E-02 -0.17648E-04 327 0.357E-02 0.189E-02
DAV: 23 -0.383418157734E+03 -0.27763E-02 -0.99682E-05 300 0.208E-02 0.113E-02
DAV: 24 -0.383420315353E+03 -0.21576E-02 -0.11985E-04 282 0.201E-02 0.120E-02
DAV: 25 -0.383421328852E+03 -0.10135E-02 -0.50502E-05 300 0.129E-02 0.810E-03
DAV: 26 -0.383421687623E+03 -0.35877E-03 -0.12748E-05 219 0.923E-03 0.340E-03
DAV: 27 -0.383421852267E+03 -0.16464E-03 -0.61173E-06 228 0.544E-03 0.301E-03
DAV: 28 -0.383421944524E+03 -0.92258E-04 -0.30983E-06 210 0.427E-03 0.152E-03
DAV: 29 -0.383422008112E+03 -0.63588E-04 -0.35794E-06 219 0.453E-03 0.173E-03
DAV: 30 -0.383422023931E+03 -0.15818E-04 -0.11319E-06 228 0.240E-03 0.142E-03
DAV: 31 -0.383422041632E+03 -0.17701E-04 -0.10309E-06 210 0.280E-03 0.715E-04
DAV: 32 -0.383422048848E+03 -0.72165E-05 -0.49103E-07 219 0.157E-03
1 F= -.38342205E+03 E0= -.38343538E+03 d E =0.399843E-01