./iterations/neb0_image09_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 0.374142565118E+03 0.37414E+03 -0.14281E+04 624 0.799E+02
DAV: 2 0.331003022315E+01 -0.37083E+03 -0.35818E+03 869 0.196E+02
DAV: 3 -0.967640032724E+02 -0.10007E+03 -0.99746E+02 661 0.117E+02
DAV: 4 -0.101284392928E+03 -0.45204E+01 -0.45099E+01 720 0.287E+01
DAV: 5 -0.101372868497E+03 -0.88476E-01 -0.88438E-01 736 0.364E+00 0.227E+01
DAV: 6 -0.926824540718E+02 0.86904E+01 -0.31027E+01 720 0.301E+01 0.119E+01
DAV: 7 -0.918126099030E+02 0.86984E+00 -0.17201E+00 720 0.613E+00 0.480E+00
DAV: 8 -0.914366748056E+02 0.37594E+00 -0.54114E-01 712 0.394E+00 0.163E+00
DAV: 9 -0.913553799714E+02 0.81295E-01 -0.13250E-01 712 0.155E+00 0.422E-01
DAV: 10 -0.913472676068E+02 0.81124E-02 -0.44669E-02 768 0.109E+00 0.302E-01
DAV: 11 -0.913517559462E+02 -0.44883E-02 -0.12564E-02 608 0.585E-01 0.137E-01
DAV: 12 -0.913548645442E+02 -0.31086E-02 -0.28100E-03 623 0.238E-01 0.108E-01
DAV: 13 -0.913584380138E+02 -0.35735E-02 -0.15847E-03 685 0.211E-01 0.430E-02
DAV: 14 -0.913619882823E+02 -0.35503E-02 -0.69609E-04 656 0.155E-01 0.323E-02
DAV: 15 -0.913630138295E+02 -0.10255E-02 -0.11489E-04 712 0.720E-02 0.309E-02
DAV: 16 -0.913644430256E+02 -0.14292E-02 -0.39195E-04 634 0.111E-01 0.231E-02
DAV: 17 -0.913647286408E+02 -0.28562E-03 -0.61428E-05 712 0.608E-02 0.130E-02
DAV: 18 -0.913649399670E+02 -0.21133E-03 -0.47962E-05 637 0.355E-02 0.104E-02
DAV: 19 -0.913650868639E+02 -0.14690E-03 -0.15746E-05 453 0.199E-02 0.432E-03
DAV: 20 -0.913651245955E+02 -0.37732E-04 -0.75499E-06 496 0.150E-02 0.195E-03
DAV: 21 -0.913651453082E+02 -0.20713E-04 -0.41059E-06 426 0.102E-02 0.217E-03
DAV: 22 -0.913651504999E+02 -0.51917E-05 -0.10116E-06 488 0.455E-03
1 F= -.91365150E+02 E0= -.91369997E+02 d E =0.145383E-01