iterations/neb0_image01_iter30_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 0.144717309241E+04 0.14472E+04 -0.44193E+04 330 0.697E+02
DAV: 2 0.224107440348E+03 -0.12231E+04 -0.11459E+04 435 0.163E+02
DAV: 3 -0.363080828428E+03 -0.58719E+03 -0.58375E+03 345 0.114E+02
DAV: 4 -0.433508037800E+03 -0.70427E+02 -0.70152E+02 318 0.508E+01
DAV: 5 -0.435080564959E+03 -0.15725E+01 -0.15700E+01 318 0.779E+00 0.426E+01
DAV: 6 -0.389101408570E+03 0.45979E+02 -0.14808E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385630752607E+03 0.34707E+01 -0.13587E+01 345 0.780E+00 0.104E+01
DAV: 8 -0.384152331126E+03 0.14784E+01 -0.21197E+00 327 0.383E+00 0.433E+00
DAV: 9 -0.383611097563E+03 0.54123E+00 -0.17591E+00 336 0.243E+00 0.138E+00
DAV: 10 -0.383539980539E+03 0.71117E-01 -0.27726E-01 318 0.114E+00 0.104E+00
DAV: 11 -0.383519965004E+03 0.20016E-01 -0.29068E-01 354 0.645E-01 0.993E-01
DAV: 12 -0.383493203743E+03 0.26761E-01 -0.22760E-01 327 0.699E-01 0.915E-01
DAV: 13 -0.383476805852E+03 0.16398E-01 -0.17613E-01 363 0.545E-01 0.668E-01
DAV: 14 -0.383464745758E+03 0.12060E-01 -0.20832E-02 354 0.381E-01 0.321E-01
DAV: 15 -0.383462227567E+03 0.25182E-02 -0.12976E-02 309 0.379E-01 0.186E-01
DAV: 16 -0.383468455551E+03 -0.62280E-02 -0.61678E-03 327 0.248E-01 0.193E-01
DAV: 17 -0.383476676046E+03 -0.82205E-02 -0.28939E-03 300 0.185E-01 0.167E-01
DAV: 18 -0.383482888765E+03 -0.62127E-02 -0.26939E-03 363 0.156E-01 0.127E-01
DAV: 19 -0.383491427004E+03 -0.85382E-02 -0.44430E-03 372 0.156E-01 0.169E-01
DAV: 20 -0.383491956900E+03 -0.52990E-03 -0.23783E-03 318 0.819E-02 0.868E-02
DAV: 21 -0.383497521178E+03 -0.55643E-02 -0.66945E-04 318 0.686E-02 0.101E-01
DAV: 22 -0.383501983927E+03 -0.44627E-02 -0.56138E-04 327 0.557E-02 0.393E-02
DAV: 23 -0.383506093433E+03 -0.41095E-02 -0.24973E-04 318 0.459E-02 0.583E-02
DAV: 24 -0.383509192009E+03 -0.30986E-02 -0.18022E-04 309 0.326E-02 0.336E-02
DAV: 25 -0.383511121699E+03 -0.19297E-02 -0.99850E-05 318 0.219E-02 0.229E-02
DAV: 26 -0.383512215139E+03 -0.10934E-02 -0.61125E-05 309 0.178E-02 0.120E-02
DAV: 27 -0.383513137775E+03 -0.92264E-03 -0.39768E-05 318 0.131E-02 0.137E-02
DAV: 28 -0.383513727941E+03 -0.59017E-03 -0.28919E-05 264 0.104E-02 0.718E-03
DAV: 29 -0.383513951593E+03 -0.22365E-03 -0.10803E-05 237 0.713E-03 0.413E-03
DAV: 30 -0.383514077359E+03 -0.12577E-03 -0.58835E-06 210 0.502E-03 0.331E-03
DAV: 31 -0.383514174333E+03 -0.96974E-04 -0.47969E-06 219 0.370E-03 0.241E-03
DAV: 32 -0.383514192780E+03 -0.18447E-04 -0.10588E-06 228 0.212E-03 0.119E-03
DAV: 33 -0.383514219396E+03 -0.26617E-04 -0.11543E-06 192 0.223E-03 0.126E-03
DAV: 34 -0.383514228653E+03 -0.92573E-05 -0.42614E-07 228 0.140E-03
1 F= -.38351423E+03 E0= -.38353090E+03 d E =0.500134E-01