iterations/neb0_image06_iter51_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 0.144840968562E+04 0.14484E+04 -0.44233E+04 330 0.697E+02
DAV: 2 0.230386195105E+03 -0.12180E+04 -0.11416E+04 417 0.163E+02
DAV: 3 -0.367841262990E+03 -0.59823E+03 -0.59493E+03 363 0.114E+02
DAV: 4 -0.433101457390E+03 -0.65260E+02 -0.65030E+02 300 0.473E+01
DAV: 5 -0.434531948393E+03 -0.14305E+01 -0.14274E+01 336 0.733E+00 0.427E+01
DAV: 6 -0.388600673754E+03 0.45931E+02 -0.15018E+02 309 0.287E+01 0.208E+01
DAV: 7 -0.385139020189E+03 0.34617E+01 -0.12626E+01 345 0.773E+00 0.104E+01
DAV: 8 -0.383702957231E+03 0.14361E+01 -0.26922E+00 327 0.383E+00 0.429E+00
DAV: 9 -0.383128198009E+03 0.57476E+00 -0.62597E-01 336 0.201E+00 0.985E-01
DAV: 10 -0.383062937132E+03 0.65261E-01 -0.22560E-01 327 0.109E+00 0.960E-01
DAV: 11 -0.383053346473E+03 0.95907E-02 -0.24087E-01 336 0.569E-01 0.715E-01
DAV: 12 -0.383017482640E+03 0.35864E-01 -0.47083E-02 318 0.464E-01 0.358E-01
DAV: 13 -0.383002784232E+03 0.14698E-01 -0.31628E-02 345 0.531E-01 0.534E-01
DAV: 14 -0.382999605437E+03 0.31788E-02 -0.11032E-02 327 0.269E-01 0.330E-01
DAV: 15 -0.383002803076E+03 -0.31976E-02 -0.13163E-02 300 0.247E-01 0.187E-01
DAV: 16 -0.383010527763E+03 -0.77247E-02 -0.49567E-03 327 0.225E-01 0.114E-01
DAV: 17 -0.383021136894E+03 -0.10609E-01 -0.54201E-03 300 0.171E-01 0.187E-01
DAV: 18 -0.383029462077E+03 -0.83252E-02 -0.44540E-03 345 0.146E-01 0.624E-02
DAV: 19 -0.383035439923E+03 -0.59778E-02 -0.10089E-03 345 0.843E-02 0.688E-02
DAV: 20 -0.383037163343E+03 -0.17234E-02 -0.21924E-04 354 0.401E-02 0.738E-02
DAV: 21 -0.383037500352E+03 -0.33701E-03 -0.36911E-05 300 0.154E-02 0.745E-02
DAV: 22 -0.383037496227E+03 0.41254E-05 -0.39335E-06 264 0.403E-03
1 F= -.38303750E+03 E0= -.38305479E+03 d E =0.518783E-01