iterations/neb0_image07_iter43_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 0.143748790417E+04 0.14375E+04 -0.44168E+04 330 0.697E+02
DAV: 2 0.237185467700E+03 -0.12003E+04 -0.11260E+04 408 0.162E+02
DAV: 3 -0.356391310795E+03 -0.59358E+03 -0.58950E+03 363 0.115E+02
DAV: 4 -0.427161575971E+03 -0.70770E+02 -0.70458E+02 300 0.496E+01
DAV: 5 -0.428834230331E+03 -0.16727E+01 -0.16688E+01 336 0.782E+00 0.422E+01
DAV: 6 -0.384238566349E+03 0.44596E+02 -0.14732E+02 309 0.285E+01 0.206E+01
DAV: 7 -0.380937917505E+03 0.33006E+01 -0.12718E+01 327 0.790E+00 0.103E+01
DAV: 8 -0.379478011691E+03 0.14599E+01 -0.18689E+00 327 0.385E+00 0.426E+00
DAV: 9 -0.378926923852E+03 0.55109E+00 -0.62194E-01 318 0.197E+00 0.107E+00
DAV: 10 -0.378897135316E+03 0.29789E-01 -0.49054E-01 381 0.112E+00 0.106E+00
DAV: 11 -0.378860845628E+03 0.36290E-01 -0.15112E-01 336 0.557E-01 0.692E-01
DAV: 12 -0.378845163202E+03 0.15682E-01 -0.39679E-02 372 0.368E-01 0.486E-01
DAV: 13 -0.378822984920E+03 0.22178E-01 -0.36165E-02 309 0.440E-01 0.442E-01
DAV: 14 -0.378818233319E+03 0.47516E-02 -0.19854E-02 363 0.353E-01 0.197E-01
DAV: 15 -0.378822650039E+03 -0.44167E-02 -0.48961E-03 300 0.228E-01 0.149E-01
DAV: 16 -0.378832995590E+03 -0.10346E-01 -0.54633E-03 309 0.245E-01 0.112E-01
DAV: 17 -0.378842344153E+03 -0.93486E-02 -0.33096E-03 327 0.166E-01 0.824E-02
DAV: 18 -0.378849711281E+03 -0.73671E-02 -0.14542E-03 318 0.120E-01 0.725E-02
DAV: 19 -0.378860669022E+03 -0.10958E-01 -0.11852E-03 327 0.996E-02 0.355E-02
DAV: 20 -0.378864664793E+03 -0.39958E-02 -0.46750E-04 318 0.514E-02 0.260E-02
DAV: 21 -0.378867182815E+03 -0.25180E-02 -0.10315E-04 309 0.235E-02 0.176E-02
DAV: 22 -0.378870206709E+03 -0.30239E-02 -0.15012E-04 300 0.252E-02 0.885E-03
DAV: 23 -0.378871791244E+03 -0.15845E-02 -0.91808E-05 309 0.185E-02 0.710E-03
DAV: 24 -0.378872430353E+03 -0.63911E-03 -0.22754E-05 264 0.942E-03 0.449E-03
DAV: 25 -0.378872805689E+03 -0.37534E-03 -0.13062E-05 228 0.678E-03 0.293E-03
DAV: 26 -0.378872928238E+03 -0.12255E-03 -0.44565E-06 228 0.448E-03 0.259E-03
DAV: 27 -0.378873007439E+03 -0.79200E-04 -0.40319E-06 210 0.472E-03 0.199E-03
DAV: 28 -0.378873023062E+03 -0.15623E-04 -0.11301E-06 237 0.259E-03 0.143E-03
DAV: 29 -0.378873048420E+03 -0.25358E-04 -0.16028E-06 210 0.331E-03 0.127E-03
DAV: 30 -0.378873067645E+03 -0.19226E-04 -0.77602E-07 219 0.236E-03 0.748E-04
DAV: 31 -0.378873073032E+03 -0.53871E-05 -0.50723E-07 228 0.153E-03
1 F= -.37887307E+03 E0= -.37888639E+03 d E =0.399520E-01