./iterations/neb0_image05_iter222_OSZICAR.out output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.365926145025E+03 0.36593E+03 -0.14284E+04 624 0.799E+02
DAV: 2 0.264043340254E+01 -0.36329E+03 -0.34995E+03 864 0.195E+02
DAV: 3 -0.954455395254E+02 -0.98086E+02 -0.97744E+02 685 0.116E+02
DAV: 4 -0.998139824884E+02 -0.43684E+01 -0.43584E+01 720 0.274E+01
DAV: 5 -0.999015924282E+02 -0.87610E-01 -0.87568E-01 728 0.344E+00 0.220E+01
DAV: 6 -0.914619765994E+02 0.84396E+01 -0.30584E+01 696 0.297E+01 0.116E+01
DAV: 7 -0.906585106236E+02 0.80347E+00 -0.17089E+00 720 0.632E+00 0.482E+00
DAV: 8 -0.902828066855E+02 0.37570E+00 -0.55140E-01 712 0.432E+00 0.165E+00
DAV: 9 -0.901996163277E+02 0.83190E-01 -0.13152E-01 712 0.171E+00 0.434E-01
DAV: 10 -0.901920467510E+02 0.75696E-02 -0.40342E-02 728 0.116E+00 0.312E-01
DAV: 11 -0.901951120081E+02 -0.30653E-02 -0.72500E-03 608 0.648E-01 0.146E-01
DAV: 12 -0.901967043991E+02 -0.15924E-02 -0.34043E-03 648 0.353E-01 0.986E-02
DAV: 13 -0.901998505963E+02 -0.31462E-02 -0.14571E-03 607 0.196E-01 0.834E-02
DAV: 14 -0.902029198310E+02 -0.30692E-02 -0.50959E-04 671 0.125E-01 0.461E-02
DAV: 15 -0.902058201787E+02 -0.29003E-02 -0.60054E-04 645 0.103E-01 0.324E-02
DAV: 16 -0.902076420349E+02 -0.18219E-02 -0.25270E-04 720 0.927E-02 0.176E-02
DAV: 17 -0.902084692775E+02 -0.82724E-03 -0.80402E-05 680 0.508E-02 0.156E-02
DAV: 18 -0.902088138348E+02 -0.34456E-03 -0.84477E-05 656 0.574E-02 0.140E-02
DAV: 19 -0.902090559870E+02 -0.24215E-03 -0.72916E-05 655 0.567E-02 0.136E-02
DAV: 20 -0.902090978639E+02 -0.41877E-04 -0.13407E-05 488 0.270E-02 0.855E-03
DAV: 21 -0.902091230005E+02 -0.25137E-04 -0.16945E-05 504 0.242E-02 0.286E-03
DAV: 22 -0.902091582605E+02 -0.35260E-04 -0.55772E-06 412 0.143E-02 0.149E-03
DAV: 23 -0.902091642179E+02 -0.59574E-05 -0.20873E-06 493 0.645E-03
1 F= -.90209164E+02 E0= -.90218008E+02 d E =0.265302E-01