iterations/neb0_image04_iter33_OSZICAR.out output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)
Status: finishedN E dE d eps ncg rms rms(c) DAV: 1 0.372050275479E+03 0.37205E+03 -0.14329E+04 632 0.799E+02 DAV: 2 0.526981008164E+01 -0.36678E+03 -0.35488E+03 861 0.195E+02 DAV: 3 -0.949800117147E+02 -0.10025E+03 -0.99907E+02 669 0.117E+02 DAV: 4 -0.994627357949E+02 -0.44827E+01 -0.44722E+01 728 0.288E+01 DAV: 5 -0.995461385238E+02 -0.83403E-01 -0.83373E-01 728 0.359E+00 0.223E+01 DAV: 6 -0.909042212263E+02 0.86419E+01 -0.30243E+01 690 0.297E+01 0.117E+01 DAV: 7 -0.900420936131E+02 0.86213E+00 -0.17939E+00 720 0.630E+00 0.479E+00 DAV: 8 -0.896431992001E+02 0.39889E+00 -0.56654E-01 712 0.433E+00 0.169E+00 DAV: 9 -0.895480995708E+02 0.95100E-01 -0.14513E-01 720 0.178E+00 0.443E-01 DAV: 10 -0.895387518591E+02 0.93477E-02 -0.41128E-02 728 0.109E+00 0.320E-01 DAV: 11 -0.895426357220E+02 -0.38839E-02 -0.11959E-02 605 0.621E-01 0.148E-01 DAV: 12 -0.895439696168E+02 -0.13339E-02 -0.25659E-03 680 0.302E-01 0.119E-01 DAV: 13 -0.895490540329E+02 -0.50844E-02 -0.56352E-03 740 0.545E-01 0.108E-01 DAV: 14 -0.895506691285E+02 -0.16151E-02 -0.14467E-03 693 0.248E-01 0.735E-02 DAV: 15 -0.895520813844E+02 -0.14123E-02 -0.92885E-04 688 0.170E-01 0.292E-02 DAV: 16 -0.895545985258E+02 -0.25171E-02 -0.46755E-04 636 0.120E-01 0.408E-02 DAV: 17 -0.895551755260E+02 -0.57700E-03 -0.10009E-04 757 0.742E-02 0.346E-02 DAV: 18 -0.895558223996E+02 -0.64687E-03 -0.21583E-04 746 0.105E-01 0.160E-02 DAV: 19 -0.895560570224E+02 -0.23462E-03 -0.70687E-05 717 0.487E-02 0.156E-02 DAV: 20 -0.895561714517E+02 -0.11443E-03 -0.42140E-05 642 0.386E-02 0.105E-02 DAV: 21 -0.895562470595E+02 -0.75608E-04 -0.95695E-06 461 0.210E-02 0.757E-03 DAV: 22 -0.895562812253E+02 -0.34166E-04 -0.22416E-05 500 0.290E-02 0.419E-03 DAV: 23 -0.895562948339E+02 -0.13609E-04 -0.70995E-06 496 0.174E-02 0.267E-03 DAV: 24 -0.895563050433E+02 -0.10209E-04 -0.27316E-06 428 0.799E-03 0.221E-03 DAV: 25 -0.895563112318E+02 -0.61885E-05 -0.10320E-06 477 0.494E-03 1 F= -.89556311E+02 E0= -.89561169E+02 d E =0.145740E-01