iterations/neb0_image07_iter33_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 0.144948614835E+04 0.14495E+04 -0.44234E+04 330 0.697E+02
DAV: 2 0.235767771346E+03 -0.12137E+04 -0.11382E+04 408 0.163E+02
DAV: 3 -0.367035996406E+03 -0.60280E+03 -0.59936E+03 363 0.116E+02
DAV: 4 -0.433103460234E+03 -0.66067E+02 -0.65828E+02 309 0.478E+01
DAV: 5 -0.434526623605E+03 -0.14232E+01 -0.14205E+01 318 0.735E+00 0.426E+01
DAV: 6 -0.388764969732E+03 0.45762E+02 -0.14929E+02 309 0.287E+01 0.208E+01
DAV: 7 -0.385339413655E+03 0.34256E+01 -0.12911E+01 345 0.774E+00 0.104E+01
DAV: 8 -0.383861927896E+03 0.14775E+01 -0.18273E+00 336 0.379E+00 0.431E+00
DAV: 9 -0.383346109519E+03 0.51582E+00 -0.16677E+00 336 0.223E+00 0.115E+00
DAV: 10 -0.383266170081E+03 0.79939E-01 -0.15045E-01 327 0.102E+00 0.915E-01
DAV: 11 -0.383224470071E+03 0.41700E-01 -0.64114E-02 318 0.697E-01 0.608E-01
DAV: 12 -0.383201548165E+03 0.22922E-01 -0.20081E-02 336 0.436E-01 0.393E-01
DAV: 13 -0.383190200114E+03 0.11348E-01 -0.19998E-02 327 0.385E-01 0.428E-01
DAV: 14 -0.383185010173E+03 0.51899E-02 -0.21021E-02 318 0.380E-01 0.243E-01
DAV: 15 -0.383187952711E+03 -0.29425E-02 -0.81029E-03 327 0.243E-01 0.169E-01
DAV: 16 -0.383195335998E+03 -0.73833E-02 -0.38150E-03 291 0.185E-01 0.165E-01
DAV: 17 -0.383203845544E+03 -0.85095E-02 -0.37222E-03 318 0.153E-01 0.117E-01
DAV: 18 -0.383211215785E+03 -0.73702E-02 -0.78186E-03 309 0.141E-01 0.197E-01
DAV: 19 -0.383218600166E+03 -0.73844E-02 -0.53559E-03 309 0.117E-01 0.540E-02
DAV: 20 -0.383227532051E+03 -0.89319E-02 -0.10665E-03 309 0.745E-02 0.950E-02
DAV: 21 -0.383232396438E+03 -0.48644E-02 -0.74415E-04 318 0.494E-02 0.214E-02
DAV: 22 -0.383234824253E+03 -0.24278E-02 -0.15838E-04 318 0.278E-02 0.230E-02
DAV: 23 -0.383236842215E+03 -0.20180E-02 -0.11815E-04 300 0.187E-02 0.936E-03
DAV: 24 -0.383237954117E+03 -0.11119E-02 -0.51054E-05 291 0.122E-02 0.689E-03
DAV: 25 -0.383238527681E+03 -0.57356E-03 -0.20354E-05 237 0.807E-03 0.344E-03
DAV: 26 -0.383238734868E+03 -0.20719E-03 -0.51199E-06 228 0.477E-03 0.237E-03
DAV: 27 -0.383238899283E+03 -0.16442E-03 -0.61084E-06 192 0.537E-03 0.254E-03
DAV: 28 -0.383238947046E+03 -0.47763E-04 -0.19256E-06 228 0.282E-03 0.146E-03
DAV: 29 -0.383238978763E+03 -0.31717E-04 -0.12606E-06 192 0.242E-03 0.789E-04
DAV: 30 -0.383239000077E+03 -0.21313E-04 -0.80184E-07 219 0.168E-03 0.688E-04
DAV: 31 -0.383239008677E+03 -0.86003E-05 -0.38675E-07 219 0.124E-03
1 F= -.38323901E+03 E0= -.38325611E+03 d E =0.512974E-01