./iterations/neb0_image06_iter202_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 0.370710861726E+03 0.37071E+03 -0.14347E+04 640 0.799E+02
DAV: 2 0.435677289998E+01 -0.36635E+03 -0.35434E+03 858 0.193E+02
DAV: 3 -0.956167931749E+02 -0.99974E+02 -0.99643E+02 664 0.116E+02
DAV: 4 -0.100392373909E+03 -0.47756E+01 -0.47605E+01 728 0.289E+01
DAV: 5 -0.100490806799E+03 -0.98433E-01 -0.98372E-01 736 0.370E+00 0.225E+01
DAV: 6 -0.919268427887E+02 0.85640E+01 -0.30648E+01 693 0.303E+01 0.118E+01
DAV: 7 -0.911113243038E+02 0.81552E+00 -0.17517E+00 704 0.627E+00 0.480E+00
DAV: 8 -0.907376467910E+02 0.37368E+00 -0.53287E-01 704 0.407E+00 0.167E+00
DAV: 9 -0.906464136476E+02 0.91233E-01 -0.12976E-01 704 0.157E+00 0.421E-01
DAV: 10 -0.906361739497E+02 0.10240E-01 -0.39005E-02 744 0.980E-01 0.288E-01
DAV: 11 -0.906405779673E+02 -0.44040E-02 -0.99544E-03 599 0.513E-01 0.146E-01
DAV: 12 -0.906432771775E+02 -0.26992E-02 -0.21627E-03 634 0.249E-01 0.864E-02
DAV: 13 -0.906474116542E+02 -0.41345E-02 -0.15866E-03 642 0.188E-01 0.601E-02
DAV: 14 -0.906505622817E+02 -0.31506E-02 -0.86174E-04 768 0.215E-01 0.369E-02
DAV: 15 -0.906525355359E+02 -0.19733E-02 -0.33594E-04 610 0.970E-02 0.391E-02
DAV: 16 -0.906537305178E+02 -0.11950E-02 -0.25608E-04 725 0.967E-02 0.153E-02
DAV: 17 -0.906544739360E+02 -0.74342E-03 -0.11918E-04 669 0.541E-02 0.143E-02
DAV: 18 -0.906547456170E+02 -0.27168E-03 -0.22321E-05 525 0.210E-02 0.865E-03
DAV: 19 -0.906548682716E+02 -0.12265E-03 -0.24155E-05 511 0.252E-02 0.253E-03
DAV: 20 -0.906548891080E+02 -0.20836E-04 -0.32442E-06 528 0.984E-03 0.240E-03
DAV: 21 -0.906549135505E+02 -0.24442E-04 -0.39917E-06 395 0.897E-03 0.154E-03
DAV: 22 -0.906549146959E+02 -0.11454E-05 -0.52651E-07 512 0.415E-03
1 F= -.90654915E+02 E0= -.90659751E+02 d E =0.145085E-01