./iterations/neb0_image03_iter14_OSZICAR.out output for 41: 3.3A-->1.3A (Job 121) O-H...N hydrogen bond by TSA-OH, TSA-NH2 (TSS)
Status: finishedN E dE d eps ncg rms rms(c) DAV: 1 0.403833944271E+03 0.40383E+03 -0.15917E+04 424 0.706E+02 DAV: 2 -0.130275761112E+02 -0.41686E+03 -0.39824E+03 593 0.166E+02 DAV: 3 -0.140174510332E+03 -0.12715E+03 -0.12648E+03 528 0.973E+01 DAV: 4 -0.148988638048E+03 -0.88141E+01 -0.87948E+01 464 0.314E+01 DAV: 5 -0.149231642749E+03 -0.24300E+00 -0.24289E+00 528 0.478E+00 0.248E+01 DAV: 6 -0.136810567929E+03 0.12421E+02 -0.37689E+01 450 0.257E+01 0.131E+01 DAV: 7 -0.135358141870E+03 0.14524E+01 -0.47329E+00 496 0.883E+00 0.601E+00 DAV: 8 -0.134728829390E+03 0.62931E+00 -0.92037E-01 488 0.437E+00 0.210E+00 DAV: 9 -0.134574338630E+03 0.15449E+00 -0.29431E-01 480 0.217E+00 0.599E-01 DAV: 10 -0.134554817356E+03 0.19521E-01 -0.49857E-02 480 0.949E-01 0.400E-01 DAV: 11 -0.134546145714E+03 0.86716E-02 -0.93257E-03 480 0.436E-01 0.175E-01 DAV: 12 -0.134540853830E+03 0.52919E-02 -0.84771E-03 472 0.315E-01 0.127E-01 DAV: 13 -0.134545266055E+03 -0.44122E-02 -0.52645E-03 465 0.304E-01 0.995E-02 DAV: 14 -0.134551121354E+03 -0.58553E-02 -0.20138E-03 456 0.187E-01 0.633E-02 DAV: 15 -0.134556569087E+03 -0.54477E-02 -0.19348E-03 496 0.165E-01 0.508E-02 DAV: 16 -0.134559780053E+03 -0.32110E-02 -0.36282E-04 488 0.777E-02 0.338E-02 DAV: 17 -0.134563304616E+03 -0.35246E-02 -0.48132E-04 464 0.695E-02 0.129E-02 DAV: 18 -0.134564599252E+03 -0.12946E-02 -0.11811E-04 504 0.362E-02 0.173E-02 DAV: 19 -0.134565253390E+03 -0.65414E-03 -0.56113E-05 496 0.306E-02 0.663E-03 DAV: 20 -0.134565640416E+03 -0.38703E-03 -0.28474E-05 448 0.202E-02 0.668E-03 DAV: 21 -0.134565797200E+03 -0.15678E-03 -0.80866E-06 336 0.107E-02 0.449E-03 DAV: 22 -0.134565843776E+03 -0.46576E-04 -0.41666E-06 344 0.747E-03 0.178E-03 DAV: 23 -0.134565893266E+03 -0.49490E-04 -0.42435E-06 320 0.747E-03 0.174E-03 DAV: 24 -0.134565908858E+03 -0.15592E-04 -0.17882E-06 336 0.397E-03 0.136E-03 DAV: 25 -0.134565913236E+03 -0.43774E-05 -0.95628E-07 344 0.367E-03 1 F= -.13456591E+03 E0= -.13457172E+03 d E =0.174319E-01