./iterations/neb0_image09_iter9_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 0.409658882564E+03 0.40966E+03 -0.15911E+04 424 0.706E+02 DAV: 2 -0.109011665987E+02 -0.42056E+03 -0.40121E+03 608 0.166E+02 DAV: 3 -0.141432693046E+03 -0.13053E+03 -0.12992E+03 560 0.983E+01 DAV: 4 -0.149003156542E+03 -0.75705E+01 -0.75585E+01 464 0.291E+01 DAV: 5 -0.149184138446E+03 -0.18098E+00 -0.18088E+00 528 0.423E+00 0.250E+01 DAV: 6 -0.136699160891E+03 0.12485E+02 -0.36743E+01 450 0.256E+01 0.133E+01 DAV: 7 -0.135180020192E+03 0.15191E+01 -0.47574E+00 496 0.895E+00 0.599E+00 DAV: 8 -0.134550409639E+03 0.62961E+00 -0.87955E-01 496 0.432E+00 0.211E+00 DAV: 9 -0.134381547295E+03 0.16886E+00 -0.27897E-01 480 0.215E+00 0.572E-01 DAV: 10 -0.134357285228E+03 0.24262E-01 -0.63197E-02 488 0.107E+00 0.396E-01 DAV: 11 -0.134347494929E+03 0.97903E-02 -0.12466E-02 472 0.552E-01 0.165E-01 DAV: 12 -0.134344771187E+03 0.27237E-02 -0.56071E-03 456 0.331E-01 0.139E-01 DAV: 13 -0.134349424582E+03 -0.46534E-02 -0.63752E-03 497 0.417E-01 0.108E-01 DAV: 14 -0.134354295485E+03 -0.48709E-02 -0.23405E-03 464 0.216E-01 0.905E-02 DAV: 15 -0.134359405559E+03 -0.51101E-02 -0.21242E-03 488 0.213E-01 0.478E-02 DAV: 16 -0.134363098381E+03 -0.36928E-02 -0.45737E-04 488 0.932E-02 0.422E-02 DAV: 17 -0.134365714413E+03 -0.26160E-02 -0.15540E-04 464 0.459E-02 0.308E-02 DAV: 18 -0.134368427371E+03 -0.27130E-02 -0.38094E-04 528 0.753E-02 0.134E-02 DAV: 19 -0.134369501403E+03 -0.10740E-02 -0.13058E-04 496 0.484E-02 0.142E-02 DAV: 20 -0.134369808392E+03 -0.30699E-03 -0.16192E-05 344 0.168E-02 0.127E-02 DAV: 21 -0.134370273360E+03 -0.46497E-03 -0.43305E-05 378 0.208E-02 0.525E-03 DAV: 22 -0.134370330526E+03 -0.57166E-04 -0.11792E-05 336 0.146E-02 0.362E-03 DAV: 23 -0.134370379643E+03 -0.49118E-04 -0.39707E-06 328 0.821E-03 0.333E-03 DAV: 24 -0.134370426475E+03 -0.46832E-04 -0.32209E-06 321 0.652E-03 0.158E-03 DAV: 25 -0.134370436325E+03 -0.98495E-05 -0.19962E-06 344 0.597E-03 1 F= -.13437044E+03 E0= -.13437668E+03 d E =0.187167E-01