iterations/neb0_image09_iter56_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 0.143148731155E+04 0.14315E+04 -0.44037E+04 330 0.697E+02
DAV: 2 0.230547054443E+03 -0.12009E+04 -0.11276E+04 417 0.162E+02
DAV: 3 -0.352902834424E+03 -0.58345E+03 -0.57821E+03 363 0.113E+02
DAV: 4 -0.421256531075E+03 -0.68354E+02 -0.67949E+02 309 0.485E+01
DAV: 5 -0.422847407972E+03 -0.15909E+01 -0.15874E+01 354 0.764E+00 0.420E+01
DAV: 6 -0.378256835922E+03 0.44591E+02 -0.16086E+02 300 0.296E+01 0.219E+01
DAV: 7 -0.376367828642E+03 0.18890E+01 -0.45359E+01 372 0.928E+00 0.124E+01
DAV: 8 -0.373622409703E+03 0.27454E+01 -0.40712E+00 417 0.562E+00 0.636E+00
DAV: 9 -0.372984649913E+03 0.63776E+00 -0.19354E+00 327 0.305E+00 0.310E+00
DAV: 10 -0.372908386992E+03 0.76263E-01 -0.34257E+00 381 0.183E+00 0.266E+00
DAV: 11 -0.372743515752E+03 0.16487E+00 -0.13330E+00 372 0.115E+00 0.121E+00
DAV: 12 -0.372718420051E+03 0.25096E-01 -0.15258E-01 318 0.427E-01 0.453E-01
DAV: 13 -0.372698367899E+03 0.20052E-01 -0.23498E-02 318 0.413E-01 0.255E-01
DAV: 14 -0.372697960731E+03 0.40717E-03 -0.10517E-02 318 0.306E-01 0.173E-01
DAV: 15 -0.372707220518E+03 -0.92598E-02 -0.70487E-03 336 0.254E-01 0.136E-01
DAV: 16 -0.372719699683E+03 -0.12479E-01 -0.44452E-03 309 0.222E-01 0.724E-02
DAV: 17 -0.372727791671E+03 -0.80920E-02 -0.31677E-03 327 0.163E-01 0.473E-02
DAV: 18 -0.372735852032E+03 -0.80604E-02 -0.94773E-04 309 0.748E-02 0.437E-02
DAV: 19 -0.372741687360E+03 -0.58353E-02 -0.33999E-04 354 0.375E-02 0.334E-02
DAV: 20 -0.372744808069E+03 -0.31207E-02 -0.11987E-04 327 0.267E-02 0.232E-02
DAV: 21 -0.372747745943E+03 -0.29379E-02 -0.23093E-04 309 0.247E-02 0.110E-02
DAV: 22 -0.372749250187E+03 -0.15042E-02 -0.71059E-05 309 0.162E-02 0.115E-02
DAV: 23 -0.372749998858E+03 -0.74867E-03 -0.30368E-05 255 0.959E-03 0.656E-03
DAV: 24 -0.372750360998E+03 -0.36214E-03 -0.19559E-05 228 0.927E-03 0.350E-03
DAV: 25 -0.372750538304E+03 -0.17731E-03 -0.80633E-06 228 0.675E-03 0.322E-03
DAV: 26 -0.372750591842E+03 -0.53538E-04 -0.36593E-06 219 0.453E-03 0.220E-03
DAV: 27 -0.372750645925E+03 -0.54083E-04 -0.25714E-06 210 0.404E-03 0.141E-03
DAV: 28 -0.372750681536E+03 -0.35611E-04 -0.16161E-06 219 0.256E-03 0.106E-03
DAV: 29 -0.372750695919E+03 -0.14383E-04 -0.73892E-07 219 0.195E-03 0.518E-04
DAV: 30 -0.372750706049E+03 -0.10130E-04 -0.43750E-07 219 0.122E-03 0.285E-04
DAV: 31 -0.372750710537E+03 -0.44876E-05 -0.19223E-07 219 0.720E-04
1 F= -.37275071E+03 E0= -.37275677E+03 d E =0.181918E-01