iterations/neb0_image02_iter70_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 0.1282090699999969 0.1278782199999995 0.3858059599999990 F F F 0.3738782200000017 0.1217767699999968 0.3069417000000030 F F F 0.3008797500000000 0.0875767400000029 0.6080330599999968 T T T 0.1005882799999966 0.3953216900000029 0.1494664499999985 F F F 0.0935841200000027 0.3797757899999965 0.4623573499999978 F F F 0.3516275400000026 0.3686636899999982 0.2284196399999985 F F F 0.3451306299999999 0.3445934200000025 0.5360027899999977 T T T 0.1290143800000010 0.6290026799999993 0.3817640899999972 F F F 0.3797710600000030 0.6220726700000014 0.3064522100000033 F F F 0.3347193800000028 0.5893076999999991 0.6189525799999984 T T T 0.1136749400000028 0.8938363700000025 0.1463734599999995 F F F 0.0884462300000024 0.8738079000000027 0.4633540900000028 F F F 0.3597789700000007 0.8695674200000028 0.2282849799999980 F F F 0.3474603000000016 0.8369407100000004 0.5393950599999968 T T T 0.6249543599999967 0.1710136299999974 0.3865198900000024 F F F 0.8696252000000015 0.0967265499999996 0.3079913300000001 F F F 0.8150633799999980 0.1218416500000004 0.6167191700000032 T T T 0.5968248599999981 0.3668240000000011 0.1483285099999989 F F F 0.6001779200000001 0.4225034199999982 0.4607757100000001 F F F 0.8470605699999965 0.3453719800000030 0.2292773400000030 F F F 0.8395624600000033 0.3539171999999979 0.5359770700000013 T T T 0.6323330600000006 0.6766394599999970 0.3849358900000013 F F F 0.8760226500000030 0.6024433299999998 0.3048653900000033 F F F 0.8205918800000020 0.6542056799999969 0.6491236700000016 T T T 0.6041314499999970 0.8673496099999980 0.1473908999999978 F F F 0.5901981100000029 0.9226956299999998 0.4630161799999968 F F F 0.8571581599999973 0.8481236000000010 0.2262257300000030 F F F 0.8429578100000015 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0.2673866599999997 0.0700754799999999 0.3560916799999987 F F F 0.1498538000000025 0.0697655000000026 0.6368498599999981 T T T 0.0140602099999967 0.1445164399999967 0.3359237399999984 F F F 0.8956942000000012 0.2308795399999966 0.6588695900000019 T T T 0.0508352800000011 0.5201536100000013 0.1095067999999983 F F F 0.0709466899999995 0.5269095600000000 0.4310643900000031 F F F 0.3083699700000011 0.7419741799999997 0.2680294700000019 F F F 0.3863932200000022 0.6890054300000017 0.5667265499999985 T T T 0.1658489599999982 0.7624355800000018 0.1064513199999979 F F F 0.1440919500000035 0.7781078699999995 0.4119224599999995 F F F 0.4218015000000008 0.9920657099999985 0.2680970299999998 F F F 0.3758976000000018 0.9450586999999970 0.5908711200000027 T T T 0.4766465800000006 0.8092209900000000 0.1853908599999983 F F F 0.4398877900000002 0.8700594199999969 0.4834352600000003 F F F 0.2335677800000013 0.9348007500000008 0.1919689200000008 F F F 0.1880207000000027 0.8568256699999992 0.5191720899999979 T T T 0.2771304899999976 0.5771882199999965 0.3582191599999973 F F F 0.0287768399999990 0.6421260099999984 0.3267830799999984 F F F 0.9223012499999967 0.5354622699999965 0.6797959100000028 T T T 0.5580200500000032 0.9876337099999972 0.1043122800000020 F F F 0.5755973699999970 0.0800809300000012 0.4412988200000001 F F F 0.8174854199999970 0.1947368800000007 0.2562878199999972 F F F 0.7860779700000009 0.2018954500000021 0.5563363099999989 T T T 0.6505470199999976 0.2366466399999965 0.1080753999999970 F F F 0.6588642199999981 0.3245137099999980 0.4100100799999993 F F F 0.8791322399999970 0.4447108600000007 0.2833571000000035 F F F 0.9260713099999975 0.4280694699999970 0.5857058300000020 T T T 0.9751713499999966 0.3291444899999973 0.1856938800000023 F F F 0.9465107700000033 0.3263179200000010 0.4869242500000013 F F F 0.7163203100000004 0.4051341600000029 0.1943479800000034 F F F 0.7065323200000009 0.4357067299999997 0.5143410599999996 T T T 0.7588572399999975 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