./iterations/neb0_image09_iter53_OSZICAR.out output for 745: 733-->741: H2O near HO-Si on SiO2 surface --> H-OSi + OH-Si on SiO2 surface (TSS)

Status: running

       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1     0.423656443656E+04    0.42366E+04   -0.23863E+05  2892   0.117E+03 
DAV:   2    -0.427743208799E+03   -0.46643E+04   -0.45642E+04  3366   0.329E+02 
DAV:   3    -0.942932757266E+03   -0.51519E+03   -0.51302E+03  3120   0.118E+02 
DAV:   4    -0.955231991318E+03   -0.12299E+02   -0.12254E+02  3183   0.196E+01 
DAV:   5    -0.955636351913E+03   -0.40436E+00   -0.40383E+00  3192   0.321E+00    0.813E+01
DAV:   6    -0.847654808027E+03    0.10798E+03   -0.47136E+02  3066   0.348E+01    0.376E+01
DAV:   7    -0.847074287241E+03    0.58052E+00   -0.14704E+01  3516   0.629E+00    0.148E+01
DAV:   8    -0.846734004958E+03    0.34028E+00   -0.18219E+00  3246   0.362E+00    0.605E+00
DAV:   9    -0.846639767392E+03    0.94238E-01   -0.68197E-01  3219   0.199E+00    0.144E+00
DAV:  10    -0.846632772396E+03    0.69950E-02   -0.17739E-01  3444   0.123E+00    0.142E+00
DAV:  11    -0.846594974147E+03    0.37798E-01   -0.49666E-02  3615   0.837E-01    0.851E-01
DAV:  12    -0.846586708867E+03    0.82653E-02   -0.72305E-02  3390   0.655E-01    0.669E-01
DAV:  13    -0.846582859365E+03    0.38495E-02   -0.47374E-02  3453   0.422E-01    0.493E-01
DAV:  14    -0.846585435149E+03   -0.25758E-02   -0.93354E-02  3633   0.647E-01    0.812E-01
DAV:  15    -0.846575027660E+03    0.10407E-01   -0.16931E-02  3111   0.301E-01    0.312E-01
DAV:  16    -0.846575459809E+03   -0.43215E-03   -0.69284E-03  3048   0.194E-01    0.251E-01
DAV:  17    -0.846575909459E+03   -0.44965E-03   -0.31602E-03  3255   0.161E-01    0.119E-01
DAV:  18    -0.846578253661E+03   -0.23442E-02   -0.20240E-03  3039   0.124E-01    0.101E-01
DAV:  19    -0.846581916903E+03   -0.36632E-02   -0.98698E-04  3066   0.846E-02    0.807E-02
DAV:  20    -0.846584629216E+03   -0.27123E-02   -0.84419E-04  3120   0.863E-02    0.643E-02
DAV:  21    -0.846586362614E+03   -0.17334E-02   -0.55902E-04  3084   0.527E-02    0.483E-02
DAV:  22    -0.846587455392E+03   -0.10928E-02   -0.16045E-04  3093   0.330E-02    0.245E-02
DAV:  23    -0.846588119036E+03   -0.66364E-03   -0.99656E-05  3030   0.266E-02    0.149E-02
DAV:  24    -0.846588504693E+03   -0.38566E-03   -0.38730E-05  2103   0.200E-02    0.127E-02
DAV:  25    -0.846588642070E+03   -0.13738E-03   -0.16612E-05  1968   0.970E-03    0.780E-03
DAV:  26    -0.846588710598E+03   -0.68528E-04   -0.56438E-06  1986   0.579E-03    0.454E-03
DAV:  27    -0.846588800567E+03   -0.89969E-04   -0.65810E-06  1959   0.789E-03    0.452E-03
DAV:  28    -0.846588817205E+03   -0.16638E-04   -0.41292E-06  2004   0.454E-03    0.276E-03
DAV:  29    -0.846588823616E+03   -0.64117E-05   -0.11057E-06  2004   0.229E-03 
   1 F= -.84658882E+03 E0= -.84663881E+03  d E =0.149959E+00