iterations/neb0_image03_iter32_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 0.144848104949E+04 0.14485E+04 -0.44194E+04 330 0.697E+02
DAV: 2 0.224602925524E+03 -0.12239E+04 -0.11480E+04 435 0.163E+02
DAV: 3 -0.362448668791E+03 -0.58705E+03 -0.58340E+03 345 0.114E+02
DAV: 4 -0.433346233438E+03 -0.70898E+02 -0.70667E+02 309 0.508E+01
DAV: 5 -0.434937686721E+03 -0.15915E+01 -0.15888E+01 318 0.783E+00 0.426E+01
DAV: 6 -0.389037287419E+03 0.45900E+02 -0.14789E+02 318 0.285E+01 0.208E+01
DAV: 7 -0.385590123718E+03 0.34472E+01 -0.13628E+01 345 0.780E+00 0.104E+01
DAV: 8 -0.384120204125E+03 0.14699E+01 -0.20981E+00 327 0.384E+00 0.432E+00
DAV: 9 -0.383577607099E+03 0.54260E+00 -0.15835E+00 336 0.243E+00 0.137E+00
DAV: 10 -0.383518235870E+03 0.59371E-01 -0.40403E-01 327 0.117E+00 0.102E+00
DAV: 11 -0.383484256511E+03 0.33979E-01 -0.15363E-01 354 0.647E-01 0.874E-01
DAV: 12 -0.383468014187E+03 0.16242E-01 -0.21050E-01 345 0.715E-01 0.878E-01
DAV: 13 -0.383452713699E+03 0.15300E-01 -0.16845E-01 363 0.541E-01 0.700E-01
DAV: 14 -0.383438966551E+03 0.13747E-01 -0.61812E-02 345 0.392E-01 0.412E-01
DAV: 15 -0.383436754365E+03 0.22122E-02 -0.15716E-02 318 0.420E-01 0.359E-01
DAV: 16 -0.383439750072E+03 -0.29957E-02 -0.15008E-02 327 0.257E-01 0.225E-01
DAV: 17 -0.383446630602E+03 -0.68805E-02 -0.26770E-03 291 0.152E-01 0.157E-01
DAV: 18 -0.383457287956E+03 -0.10657E-01 -0.29184E-03 309 0.155E-01 0.778E-02
DAV: 19 -0.383469315309E+03 -0.12027E-01 -0.18908E-03 309 0.144E-01 0.636E-02
DAV: 20 -0.383475309834E+03 -0.59945E-02 -0.82045E-04 327 0.836E-02 0.622E-02
DAV: 21 -0.383478639530E+03 -0.33297E-02 -0.16011E-04 327 0.323E-02 0.607E-02
DAV: 22 -0.383484366227E+03 -0.57267E-02 -0.47230E-04 291 0.452E-02 0.203E-02
DAV: 23 -0.383486460747E+03 -0.20945E-02 -0.11683E-04 327 0.242E-02 0.230E-02
DAV: 24 -0.383487217522E+03 -0.75677E-03 -0.31272E-05 300 0.152E-02 0.147E-02
DAV: 25 -0.383487916347E+03 -0.69883E-03 -0.20298E-05 228 0.110E-02 0.761E-03
DAV: 26 -0.383488725260E+03 -0.80891E-03 -0.42332E-05 273 0.101E-02 0.474E-03
DAV: 27 -0.383488944527E+03 -0.21927E-03 -0.63281E-06 237 0.714E-03 0.424E-03
DAV: 28 -0.383489102994E+03 -0.15847E-03 -0.61917E-06 210 0.496E-03 0.210E-03
DAV: 29 -0.383489145541E+03 -0.42547E-04 -0.20539E-06 237 0.332E-03 0.270E-03
DAV: 30 -0.383489193812E+03 -0.48271E-04 -0.17435E-06 192 0.302E-03 0.169E-03
DAV: 31 -0.383489216384E+03 -0.22572E-04 -0.10300E-06 219 0.187E-03 0.104E-03
DAV: 32 -0.383489225394E+03 -0.90101E-05 -0.47402E-07 228 0.169E-03
1 F= -.38348923E+03 E0= -.38350218E+03 d E =0.388704E-01