./iterations/neb0_image08_iter260_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 0.374170602468E+03 0.37417E+03 -0.14282E+04 624 0.799E+02
DAV: 2 0.390826614761E+01 -0.37026E+03 -0.35787E+03 869 0.196E+02
DAV: 3 -0.965536590725E+02 -0.10046E+03 -0.10014E+03 653 0.117E+02
DAV: 4 -0.101260298311E+03 -0.47066E+01 -0.46946E+01 720 0.293E+01
DAV: 5 -0.101352894232E+03 -0.92596E-01 -0.92544E-01 736 0.371E+00 0.227E+01
DAV: 6 -0.926560784397E+02 0.86968E+01 -0.31026E+01 717 0.301E+01 0.119E+01
DAV: 7 -0.917943211302E+02 0.86176E+00 -0.17268E+00 728 0.614E+00 0.480E+00
DAV: 8 -0.914205733215E+02 0.37375E+00 -0.53648E-01 720 0.393E+00 0.162E+00
DAV: 9 -0.913397805299E+02 0.80793E-01 -0.13185E-01 736 0.154E+00 0.419E-01
DAV: 10 -0.913315205301E+02 0.82600E-02 -0.45507E-02 744 0.109E+00 0.304E-01
DAV: 11 -0.913364026284E+02 -0.48821E-02 -0.14615E-02 616 0.628E-01 0.155E-01
DAV: 12 -0.913392446961E+02 -0.28421E-02 -0.28110E-03 626 0.226E-01 0.117E-01
DAV: 13 -0.913430775576E+02 -0.38329E-02 -0.30816E-03 639 0.291E-01 0.614E-02
DAV: 14 -0.913461636995E+02 -0.30861E-02 -0.83968E-04 664 0.164E-01 0.231E-02
DAV: 15 -0.913476944517E+02 -0.15308E-02 -0.15876E-04 664 0.603E-02 0.155E-02
DAV: 16 -0.913487517039E+02 -0.10573E-02 -0.12322E-04 647 0.562E-02 0.103E-02
DAV: 17 -0.913490962846E+02 -0.34458E-03 -0.28879E-05 584 0.235E-02 0.847E-03
DAV: 18 -0.913492381384E+02 -0.14185E-03 -0.16100E-05 488 0.240E-02 0.327E-03
DAV: 19 -0.913493181276E+02 -0.79989E-04 -0.10773E-05 453 0.131E-02 0.312E-03
DAV: 20 -0.913493328401E+02 -0.14712E-04 -0.20308E-06 512 0.879E-03 0.172E-03
DAV: 21 -0.913493471418E+02 -0.14302E-04 -0.41608E-06 406 0.119E-02 0.269E-03
DAV: 22 -0.913493478872E+02 -0.74544E-06 -0.81718E-07 520 0.673E-03
1 F= -.91349348E+02 E0= -.91354401E+02 d E =0.151579E-01