./iterations/neb0_image04_iter66_OSZICAR.out output for 745: 733-->741: H2O near HO-Si on SiO2 surface --> H-OSi + OH-Si on SiO2 surface (TSS)
Status: runningN E dE d eps ncg rms rms(c) DAV: 1 0.423785787151E+04 0.42379E+04 -0.23868E+05 2892 0.117E+03 DAV: 2 -0.428835740689E+03 -0.46667E+04 -0.45702E+04 3357 0.329E+02 DAV: 3 -0.942900781189E+03 -0.51407E+03 -0.51182E+03 3120 0.117E+02 DAV: 4 -0.955213519950E+03 -0.12313E+02 -0.12266E+02 3183 0.196E+01 DAV: 5 -0.955618686260E+03 -0.40517E+00 -0.40462E+00 3210 0.321E+00 0.813E+01 DAV: 6 -0.847499971955E+03 0.10812E+03 -0.47056E+02 3066 0.347E+01 0.376E+01 DAV: 7 -0.847036480439E+03 0.46349E+00 -0.14446E+01 3534 0.609E+00 0.146E+01 DAV: 8 -0.846702950846E+03 0.33353E+00 -0.96165E-01 3165 0.236E+00 0.594E+00 DAV: 9 -0.846655141382E+03 0.47809E-01 -0.40838E-01 3192 0.151E+00 0.855E-01 DAV: 10 -0.846660373874E+03 -0.52325E-02 -0.73975E-02 3111 0.610E-01 0.594E-01 DAV: 11 -0.846659464039E+03 0.90983E-03 -0.66432E-03 3102 0.210E-01 0.342E-01 DAV: 12 -0.846659713341E+03 -0.24930E-03 -0.71499E-03 3066 0.246E-01 0.120E-01 DAV: 13 -0.846662596345E+03 -0.28830E-02 -0.44688E-03 3192 0.215E-01 0.137E-01 DAV: 14 -0.846666572387E+03 -0.39760E-02 -0.30694E-03 3084 0.146E-01 0.969E-02 DAV: 15 -0.846671141692E+03 -0.45693E-02 -0.10990E-03 3057 0.860E-02 0.344E-02 DAV: 16 -0.846673586244E+03 -0.24446E-02 -0.46658E-04 3102 0.509E-02 0.374E-02 DAV: 17 -0.846674768974E+03 -0.11827E-02 -0.22603E-04 3084 0.374E-02 0.251E-02 DAV: 18 -0.846675460251E+03 -0.69128E-03 -0.31229E-05 2508 0.190E-02 0.140E-02 DAV: 19 -0.846676043474E+03 -0.58322E-03 -0.40307E-05 2679 0.210E-02 0.726E-03 DAV: 20 -0.846676149580E+03 -0.10611E-03 -0.30490E-05 2661 0.138E-02 0.652E-03 DAV: 21 -0.846676193702E+03 -0.44122E-04 -0.32995E-06 1995 0.456E-03 0.583E-03 DAV: 22 -0.846676216024E+03 -0.22322E-04 -0.22528E-06 1986 0.346E-03 0.267E-03 DAV: 23 -0.846676223080E+03 -0.70559E-05 -0.16581E-06 2004 0.288E-03 1 F= -.84667622E+03 E0= -.84668009E+03 d E =0.115959E-01