./iterations/neb0_image08_iter58_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 0.375934893815E+03 0.37593E+03 -0.14280E+04 624 0.799E+02
DAV: 2 0.376421095722E+01 -0.37217E+03 -0.35850E+03 869 0.196E+02
DAV: 3 -0.967451437652E+02 -0.10051E+03 -0.10018E+03 688 0.117E+02
DAV: 4 -0.101088552525E+03 -0.43434E+01 -0.43334E+01 704 0.275E+01
DAV: 5 -0.101173436929E+03 -0.84884E-01 -0.84849E-01 736 0.346E+00 0.227E+01
DAV: 6 -0.925585590449E+02 0.86149E+01 -0.30825E+01 701 0.302E+01 0.119E+01
DAV: 7 -0.916888299100E+02 0.86973E+00 -0.16774E+00 728 0.614E+00 0.481E+00
DAV: 8 -0.913091586874E+02 0.37967E+00 -0.56084E-01 704 0.404E+00 0.163E+00
DAV: 9 -0.912256803393E+02 0.83478E-01 -0.12861E-01 712 0.154E+00 0.427E-01
DAV: 10 -0.912161100242E+02 0.95703E-02 -0.47518E-02 728 0.112E+00 0.310E-01
DAV: 11 -0.912210062325E+02 -0.48962E-02 -0.14914E-02 616 0.626E-01 0.167E-01
DAV: 12 -0.912238778499E+02 -0.28716E-02 -0.32901E-03 636 0.247E-01 0.132E-01
DAV: 13 -0.912279120515E+02 -0.40342E-02 -0.25045E-03 717 0.287E-01 0.521E-02
DAV: 14 -0.912307805022E+02 -0.28685E-02 -0.46336E-04 656 0.108E-01 0.412E-02
DAV: 15 -0.912330620228E+02 -0.22815E-02 -0.21460E-04 653 0.619E-02 0.311E-02
DAV: 16 -0.912340676553E+02 -0.10056E-02 -0.33799E-04 677 0.889E-02 0.255E-02
DAV: 17 -0.912343459263E+02 -0.27827E-03 -0.54236E-05 624 0.473E-02 0.119E-02
DAV: 18 -0.912345608839E+02 -0.21496E-03 -0.40130E-05 570 0.269E-02 0.683E-03
DAV: 19 -0.912345908548E+02 -0.29971E-04 -0.44680E-06 528 0.160E-02 0.321E-03
DAV: 20 -0.912346338151E+02 -0.42960E-04 -0.94483E-06 395 0.180E-02 0.467E-03
DAV: 21 -0.912346476865E+02 -0.13871E-04 -0.21864E-06 472 0.996E-03 0.298E-03
DAV: 22 -0.912346516580E+02 -0.39715E-05 -0.33697E-06 482 0.110E-02
1 F= -.91234652E+02 E0= -.91239417E+02 d E =0.142949E-01