./iterations/neb0_image02_iter142_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 0.363732062488E+03 0.36373E+03 -0.14325E+04 632 0.799E+02
DAV: 2 0.284961392683E+01 -0.36088E+03 -0.34741E+03 845 0.194E+02
DAV: 3 -0.955228798287E+02 -0.98372E+02 -0.98039E+02 656 0.116E+02
DAV: 4 -0.100177781978E+03 -0.46549E+01 -0.46435E+01 720 0.291E+01
DAV: 5 -0.100268746844E+03 -0.90965E-01 -0.90930E-01 720 0.366E+00 0.222E+01
DAV: 6 -0.916680105890E+02 0.86007E+01 -0.30942E+01 688 0.298E+01 0.117E+01
DAV: 7 -0.908573917369E+02 0.81062E+00 -0.18376E+00 704 0.638E+00 0.484E+00
DAV: 8 -0.904764196152E+02 0.38097E+00 -0.55882E-01 704 0.430E+00 0.169E+00
DAV: 9 -0.903894605215E+02 0.86959E-01 -0.13793E-01 704 0.166E+00 0.434E-01
DAV: 10 -0.903837180709E+02 0.57425E-02 -0.49653E-02 712 0.133E+00 0.329E-01
DAV: 11 -0.903869981737E+02 -0.32801E-02 -0.70998E-03 608 0.507E-01 0.158E-01
DAV: 12 -0.903903436227E+02 -0.33454E-02 -0.84098E-03 640 0.516E-01 0.137E-01
DAV: 13 -0.903931227140E+02 -0.27791E-02 -0.18350E-03 936 0.351E-01 0.835E-02
DAV: 14 -0.903960615108E+02 -0.29388E-02 -0.13290E-03 645 0.173E-01 0.616E-02
DAV: 15 -0.903983017941E+02 -0.22403E-02 -0.43106E-04 664 0.111E-01 0.475E-02
DAV: 16 -0.903997477625E+02 -0.14460E-02 -0.69395E-04 664 0.153E-01 0.308E-02
DAV: 17 -0.904006134855E+02 -0.86572E-03 -0.13672E-04 666 0.757E-02 0.235E-02
DAV: 18 -0.904008259019E+02 -0.21242E-03 -0.64869E-05 688 0.404E-02 0.101E-02
DAV: 19 -0.904010244132E+02 -0.19851E-03 -0.46078E-05 618 0.358E-02 0.733E-03
DAV: 20 -0.904010471390E+02 -0.22726E-04 -0.42380E-06 480 0.178E-02 0.535E-03
DAV: 21 -0.904010778442E+02 -0.30705E-04 -0.10684E-05 437 0.193E-02 0.707E-03
DAV: 22 -0.904010959072E+02 -0.18063E-04 -0.36617E-06 480 0.145E-02 0.366E-03
DAV: 23 -0.904011053974E+02 -0.94902E-05 -0.74996E-06 432 0.148E-02
1 F= -.90401105E+02 E0= -.90407440E+02 d E =0.190050E-01