iterations/neb0_image04_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 0.144935236269E+04 0.14494E+04 -0.44202E+04 330 0.697E+02
DAV: 2 0.224990731446E+03 -0.12244E+04 -0.11493E+04 435 0.163E+02
DAV: 3 -0.362520320289E+03 -0.58751E+03 -0.58425E+03 345 0.114E+02
DAV: 4 -0.433322482480E+03 -0.70802E+02 -0.70552E+02 309 0.509E+01
DAV: 5 -0.434916951403E+03 -0.15945E+01 -0.15919E+01 318 0.784E+00 0.426E+01
DAV: 6 -0.389035947303E+03 0.45881E+02 -0.14770E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385581751845E+03 0.34542E+01 -0.13460E+01 345 0.778E+00 0.104E+01
DAV: 8 -0.384118893075E+03 0.14629E+01 -0.22737E+00 327 0.386E+00 0.435E+00
DAV: 9 -0.383578492460E+03 0.54040E+00 -0.16090E+00 336 0.240E+00 0.130E+00
DAV: 10 -0.383499149799E+03 0.79343E-01 -0.18070E-01 327 0.112E+00 0.909E-01
DAV: 11 -0.383468787984E+03 0.30362E-01 -0.10532E-01 336 0.688E-01 0.720E-01
DAV: 12 -0.383458972193E+03 0.98158E-02 -0.17235E-01 372 0.618E-01 0.787E-01
DAV: 13 -0.383445075348E+03 0.13897E-01 -0.11562E-01 354 0.472E-01 0.784E-01
DAV: 14 -0.383433663880E+03 0.11411E-01 -0.10765E-01 354 0.388E-01 0.531E-01
DAV: 15 -0.383431749960E+03 0.19139E-02 -0.90652E-02 318 0.436E-01 0.676E-01
DAV: 16 -0.383428909417E+03 0.28405E-02 -0.81118E-02 336 0.346E-01 0.238E-01
DAV: 17 -0.383434663508E+03 -0.57541E-02 -0.64904E-03 282 0.199E-01 0.203E-01
DAV: 18 -0.383438125600E+03 -0.34621E-02 -0.21269E-03 327 0.106E-01 0.137E-01
DAV: 19 -0.383451933307E+03 -0.13808E-01 -0.36848E-03 291 0.183E-01 0.135E-01
DAV: 20 -0.383456442479E+03 -0.45092E-02 -0.10373E-03 318 0.947E-02 0.715E-02
DAV: 21 -0.383463788545E+03 -0.73461E-02 -0.77770E-04 336 0.749E-02 0.700E-02
DAV: 22 -0.383469750932E+03 -0.59624E-02 -0.51006E-04 318 0.562E-02 0.307E-02
DAV: 23 -0.383472015614E+03 -0.22647E-02 -0.16209E-04 309 0.287E-02 0.281E-02
DAV: 24 -0.383475130738E+03 -0.31151E-02 -0.13369E-04 309 0.229E-02 0.239E-02
DAV: 25 -0.383477081992E+03 -0.19513E-02 -0.86170E-05 309 0.168E-02 0.119E-02
DAV: 26 -0.383478453935E+03 -0.13719E-02 -0.74419E-05 300 0.168E-02 0.168E-02
DAV: 27 -0.383479046405E+03 -0.59247E-03 -0.28313E-05 255 0.108E-02 0.766E-03
DAV: 28 -0.383479241382E+03 -0.19498E-03 -0.10907E-05 237 0.778E-03 0.548E-03
DAV: 29 -0.383479437657E+03 -0.19628E-03 -0.78435E-06 210 0.542E-03 0.602E-03
DAV: 30 -0.383479482231E+03 -0.44574E-04 -0.22506E-06 237 0.336E-03 0.314E-03
DAV: 31 -0.383479544639E+03 -0.62408E-04 -0.31549E-06 192 0.388E-03 0.143E-03
DAV: 32 -0.383479556164E+03 -0.11525E-04 -0.90754E-07 228 0.212E-03 0.159E-03
DAV: 33 -0.383479567493E+03 -0.11329E-04 -0.53748E-07 210 0.184E-03 0.904E-04
DAV: 34 -0.383479574733E+03 -0.72398E-05 -0.31251E-07 210 0.114E-03
1 F= -.38347957E+03 E0= -.38349634E+03 d E =0.502918E-01