./iterations/neb0_image09_iter8_CONTCAR output for 745: 733-->741: H2O near HO-Si on SiO2 surface --> H-OSi + OH-Si on SiO2 surface (TSS)
Status: runningNo title 1.00000000000000 9.7443200000000001 0.0000000000000000 0.0000000000000000 0.0000000000000000 9.7443200000000001 0.0000000000000000 0.0000000000000000 0.0000000000000000 23.4276799999999987 Si O H 31 70 16 Selective dynamics Direct 0.1217913999999993 0.1315237999999965 0.3862939999999995 F F F 0.3674605499999970 0.1254223500000009 0.3074297400000034 F F F 0.3043424000000030 0.0895087700000019 0.6093911600000013 T T T 0.0941706099999990 0.3989672700000000 0.1499544899999989 F F F 0.0871664499999980 0.3834213700000006 0.4628453899999982 F F F 0.3452098699999979 0.3723092700000024 0.2289076799999989 F F F 0.3401764999999983 0.3506060500000032 0.5371996100000018 T T T 0.1225967100000034 0.6326482600000034 0.3822521299999977 F F F 0.3733533899999983 0.6257182499999985 0.3069402499999967 F F F 0.3184343300000023 0.5982268699999977 0.6147690900000029 T T T 0.1072572699999981 0.8974819499999995 0.1468615000000000 F F F 0.0820285599999977 0.8774534799999998 0.4638421300000033 F F F 0.3533613000000031 0.8732129999999998 0.2287730199999984 F F F 0.3393740200000011 0.8412400500000032 0.5387317200000012 T T T 0.6185366899999991 0.1746592100000015 0.3870079300000029 F F F 0.8632075299999968 0.1003721299999967 0.3084793700000006 F F F 0.8124756400000024 0.1218816700000005 0.6165164100000027 T T T 0.5904071900000005 0.3704695799999982 0.1488165499999994 F F F 0.5937602500000025 0.4261490000000023 0.4612637500000005 F F F 0.8406428999999989 0.3490175600000001 0.2297653800000035 F F F 0.8316924800000010 0.3537829799999983 0.5361744599999980 T T T 0.6259153900000030 0.6802850400000011 0.3854239300000017 F F F 0.8696049799999983 0.6060889099999969 0.3053534299999967 F F F 0.8164805099999981 0.6576940899999997 0.6528561900000014 T T T 0.5977137799999994 0.8709951900000021 0.1478789399999982 F F F 0.5837804399999982 0.9263412099999968 0.4635042199999972 F F F 0.8507404899999997 0.8517691799999980 0.2267137700000035 F F F 0.8346815199999966 0.8565419199999980 0.5451618399999987 T T T 0.9645275299999980 0.3888116899999972 0.6504234200000027 T T T 0.5450698900000006 0.2153357799999966 0.6531845800000013 T T T 0.6218133300000019 0.4855605999999995 0.7213845899999995 T T T 0.0652132299999977 0.0186806099999970 0.1036316300000024 F F F 0.0751277999999971 0.0321993299999974 0.4387679299999974 F F F 0.2950994199999997 0.2442205700000031 0.2686939700000011 F F F 0.3078467899999993 0.1885227900000004 0.5529247699999971 T T T 0.1480431199999970 0.2721398500000021 0.1078808199999983 F F F 0.1498128599999973 0.2800334599999985 0.4152689699999996 F F F 0.4117994400000029 0.4930399799999989 0.2681713899999991 F F F 0.3536358100000001 0.4418860800000033 0.5956763800000004 T T T 0.4588111899999987 0.3123866899999967 0.1843713000000022 F F F 0.4420704099999995 0.3783973000000032 0.4809405900000030 F F F 0.2163444500000011 0.4389706199999992 0.1946863000000008 F F F 0.1913244400000025 0.4058621799999997 0.5146109900000013 T T T 0.2609689900000021 0.0737210599999969 0.3565797199999992 F F F 0.1508913099999987 0.0758242300000020 0.6368289899999979 T T T 0.0076425399999991 0.1481620200000009 0.3364117799999988 F F F 0.8958293800000021 0.2314779700000003 0.6575399099999970 T T T 0.0444176100000035 0.5237991899999983 0.1099948399999988 F F F 0.0645290200000019 0.5305551399999970 0.4315524299999964 F F F 0.3019523000000035 0.7456197599999967 0.2685175100000023 F F F 0.3742647400000010 0.6878071000000006 0.5600301400000021 T T T 0.1594312900000006 0.7660811599999988 0.1069393599999984 F F F 0.1376742799999988 0.7817534499999965 0.4124105000000000 F F F 0.4153838300000032 0.9957112900000027 0.2685850700000003 F F F 0.3716432000000012 0.9429008199999984 0.5921807599999980 T T T 0.4702289100000030 0.8128665699999971 0.1858788999999987 F F F 0.4334701200000026 0.8737050000000011 0.4839233000000007 F F F 0.2271501099999966 0.9384463299999979 0.1924569600000012 F F F 0.1806346400000010 0.8681528799999967 0.5198271699999992 T T T 0.2707128200000000 0.5808338000000006 0.3587071999999978 F F F 0.0223591700000014 0.6457715900000025 0.3272711199999989 F F F 0.9352257099999974 0.5463160700000032 0.6768749700000001 T T T 0.5516023799999985 0.9912792900000014 0.1048003200000025 F F F 0.5691796999999994 0.0837265099999982 0.4417868600000006 F F F 0.8110677499999994 0.1983824599999977 0.2567758599999976 F F F 0.7809909200000007 0.2002001199999981 0.5557592400000004 T T T 0.6441293500000000 0.2402922200000006 0.1085634399999975 F F F 0.6524465500000005 0.3281592900000021 0.4104981199999997 F F F 0.8727145699999994 0.4483564399999977 0.2838451399999968 F F F 0.9140143799999976 0.4303466200000017 0.5863628199999980 T T T 0.9687536799999990 0.3327900700000015 0.1861819200000028 F F F 0.9400930999999986 0.3299634999999981 0.4874122900000017 F F F 0.7099026400000028 0.4087797399999999 0.1948360199999968 F F F 0.6997139799999985 0.4372188099999974 0.5147547799999970 T T T 0.7524395699999999 0.1009719199999992 0.3601157499999985 F F F 0.6682126299999993 0.0954549000000000 0.6514909500000030 T T T 0.5018955500000004 0.1894271999999972 0.3382094899999970 F F F 0.3948843900000014 0.1475217500000028 0.6634222599999973 T T T 0.5478347900000031 0.4924723399999991 0.1060076099999989 F F F 0.5815036099999986 0.5824969499999995 0.4383567599999978 F F F 0.8197924600000022 0.6991610999999978 0.2517169099999990 F F F 0.8235259799999994 0.7193271699999997 0.5868034599999987 T T T 0.6482452400000014 0.7393398999999974 0.1077995899999991 F F F 0.6420782699999990 0.8341948799999983 0.4112192999999991 F F F 0.8832029499999976 0.9480841800000022 0.2818615699999967 F F F 0.8853805899999969 0.9785181399999985 0.5933563899999967 T T T 0.9787414299999995 0.8380921999999984 0.1831545399999968 F F F 0.9302890900000023 0.8320716300000015 0.4862960700000016 F F F 0.7204095399999986 0.9130090299999978 0.1919217000000017 F F F 0.6872910000000019 0.9088733000000033 0.5195019000000016 T T T 0.7698552800000016 0.6254970199999974 0.3600654000000034 F F F 0.6748545499999992 0.5689561599999990 0.6633320299999994 T T T 0.5138208799999973 0.6849176300000011 0.3345048500000019 F F F 0.3977850699999976 0.6216989200000000 0.6768906699999988 T T T 0.5671829099999997 0.3322072200000008 0.7009971100000030 T T T 0.5451162900000028 0.2777633299999991 0.5879929500000003 T T T 0.8315100599999994 0.7824848899999992 0.6993530100000029 T T T 0.1209365400000024 0.3647799199999966 0.6718555599999974 T T T 0.1599950900000024 0.6510067899999967 0.6215780699999982 T T T 0.7587687099999982 0.4310799399999965 0.7582501999999991 T T T 0.5259921399999996 0.5751297400000013 0.7674590999999964 T T T 0.0967915000000019 0.1155372600000035 0.1077401100000017 F F F 0.1933645399999975 0.3012927400000009 0.0730195200000026 F F F 0.0895797000000016 0.6155764199999965 0.1100350700000021 F F F 0.2036784900000015 0.7916028900000001 0.0713381699999971 F F F 0.5859962299999992 0.0874080399999997 0.1085174199999983 F F F 0.6827396899999982 0.2675410499999984 0.0720603899999972 F F F 0.5862665399999969 0.5871103400000024 0.1087894300000016 F F F 0.6882283999999999 0.7652751099999975 0.0713836999999984 F F F 0.6138244500000027 0.2334802299999978 0.5634352000000007 T T T 0.0813423199999974 0.0186814400000017 0.6183374200000031 T T T 0.7701858900000005 0.8606259000000023 0.6955016900000004 T T T 0.1456143200000000 0.2671890900000022 0.6725147399999969 T T T 0.1063004499999991 0.6174403600000034 0.6540013700000031 T T T 0.8326593600000010 0.4968494199999967 0.7659346200000030 T T T 0.5541740600000011 0.5546589900000001 0.8092491700000011 T T T 0.3736975200000003 0.6881359500000030 0.7034774099999979 T T T 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00