./iterations/neb0_image07_iter76_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 0.378301170541E+03 0.37830E+03 -0.14285E+04 624 0.799E+02
DAV: 2 0.374959826961E+01 -0.37455E+03 -0.36232E+03 877 0.196E+02
DAV: 3 -0.964635946889E+02 -0.10021E+03 -0.99892E+02 672 0.117E+02
DAV: 4 -0.100899218031E+03 -0.44356E+01 -0.44249E+01 712 0.283E+01
DAV: 5 -0.100986505004E+03 -0.87287E-01 -0.87252E-01 728 0.357E+00 0.228E+01
DAV: 6 -0.923472379356E+02 0.86393E+01 -0.30686E+01 701 0.303E+01 0.119E+01
DAV: 7 -0.914701464445E+02 0.87709E+00 -0.16703E+00 736 0.613E+00 0.482E+00
DAV: 8 -0.910866680100E+02 0.38348E+00 -0.55609E-01 696 0.404E+00 0.163E+00
DAV: 9 -0.910020633082E+02 0.84605E-01 -0.13391E-01 712 0.156E+00 0.426E-01
DAV: 10 -0.909924880290E+02 0.95753E-02 -0.49109E-02 720 0.115E+00 0.314E-01
DAV: 11 -0.909969596594E+02 -0.44716E-02 -0.12662E-02 608 0.598E-01 0.138E-01
DAV: 12 -0.910001591389E+02 -0.31995E-02 -0.38898E-03 624 0.291E-01 0.153E-01
DAV: 13 -0.910037741913E+02 -0.36151E-02 -0.30549E-03 725 0.343E-01 0.568E-02
DAV: 14 -0.910062402124E+02 -0.24660E-02 -0.61820E-04 664 0.119E-01 0.599E-02
DAV: 15 -0.910089763908E+02 -0.27362E-02 -0.32313E-04 639 0.851E-02 0.372E-02
DAV: 16 -0.910102535553E+02 -0.12772E-02 -0.53438E-04 669 0.116E-01 0.338E-02
DAV: 17 -0.910107681965E+02 -0.51464E-03 -0.15587E-04 664 0.747E-02 0.103E-02
DAV: 18 -0.910109438081E+02 -0.17561E-03 -0.29535E-05 597 0.267E-02 0.615E-03
DAV: 19 -0.910110060264E+02 -0.62218E-04 -0.69375E-06 464 0.161E-02 0.215E-03
DAV: 20 -0.910110508732E+02 -0.44847E-04 -0.53872E-06 414 0.946E-03 0.232E-03
DAV: 21 -0.910110614260E+02 -0.10553E-04 -0.11308E-06 496 0.547E-03 0.166E-03
DAV: 22 -0.910110678145E+02 -0.63884E-05 -0.23087E-06 383 0.951E-03
1 F= -.91011068E+02 E0= -.91016342E+02 d E =0.158221E-01