iterations/neb0_image04_iter6_CONTCAR output for 43: 3.6A-->1.6A 715(amd-3) Si-CH2H...H2HC-Si two dimer closed (TSS)
Status:
finished
No title
1.00000000000000
30.0000000000000000 0.0000000000000000 0.0000000000000000
0.0000000000000000 20.0000000000000000 0.0000000000000000
0.0000000000000000 0.0000000000000000 15.0000000000000000
C Si O N H
6 10 8 6 42
Direct
0.3547987299999988 0.5454413000000002 0.4224421600000028
0.3673917200000005 0.4364748300000016 0.5688843200000022
0.4590384700000030 0.5300847399999995 0.4119417100000007
0.5871750900000023 0.3372321000000014 0.3094372300000003
0.5231973100000005 0.3793677199999976 0.4630760399999971
0.5103267300000027 0.2375325900000007 0.2679045900000006
0.3357426900000036 0.5124406899999983 0.5334776400000010
0.4100072800000021 0.5876158700000005 0.4182368700000012
0.2305146300000018 0.4960310600000000 0.5561400699999979
0.1748237999999986 0.4130025999999987 0.6794474800000003
0.2264505899999989 0.3473038200000005 0.5236268100000032
0.5824027800000025 0.3707587700000019 0.4264401399999969
0.5712235100000029 0.2481596300000035 0.2915386900000030
0.6487725599999976 0.4906587799999969 0.4600841199999977
0.6396277799999979 0.5993563099999974 0.5974881599999975
0.6093611599999988 0.6253918399999989 0.4079643399999995
0.3390075399999972 0.5726782799999981 0.6087344500000000
0.2827989999999971 0.4904150999999999 0.5255464600000010
0.4116384200000027 0.6319672500000024 0.5133408399999979
0.4103404199999972 0.6384973899999977 0.3304588199999969
0.6110491600000003 0.3216985700000023 0.4944597000000002
0.6050228100000012 0.4457962800000033 0.4314200199999974
0.5864979799999972 0.2094916100000006 0.3857940400000004
0.6009206299999974 0.2111738899999978 0.2116295100000016
0.2108571600000033 0.4173316099999980 0.5875890599999991
0.2276757500000031 0.3596657000000008 0.4100128899999973
0.1273026200000018 0.4613196399999993 0.6722696599999978
0.6332491100000013 0.5717130000000026 0.4871258100000020
0.6203656400000028 0.6063237600000022 0.2983248800000027
0.6926143000000025 0.6191658700000033 0.6337226300000012
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0.3298655199999985 0.5825942299999980 0.4004313699999997
0.3627863199999979 0.6048516199999980 0.5956872799999999
0.3640656199999981 0.3954731999999979 0.5203887099999989
0.3547167299999998 0.4184113299999979 0.6333834899999999
0.4031087500000012 0.4474503699999985 0.5771692000000002
0.4908657100000013 0.5576251700000014 0.4112174500000023
0.4576439599999986 0.4994183900000024 0.3510189300000022
0.4600119999999990 0.4959331399999982 0.4693551200000030
0.4368829000000005 0.6612991300000033 0.5236147600000010
0.4387024800000034 0.6472701100000009 0.3016884000000033
0.2247231999999997 0.5417107800000025 0.6341515900000019
0.2049881800000009 0.5226165199999997 0.4784438000000009
0.1619386100000000 0.3412987099999967 0.6875762399999985
0.1978605899999977 0.4373424300000011 0.7613338299999981
0.2723784800000004 0.3256462599999992 0.5485463400000015
0.1933237599999984 0.2939186099999986 0.5439328100000012
0.2541063199999982 0.3836982799999973 0.3821001100000032
0.1992048199999985 0.3703696600000015 0.3760385900000003
0.1271211999999977 0.5089159799999976 0.6960277200000036
0.1046419500000013 0.4553859700000018 0.6224923600000025
0.5677524000000034 0.3689933300000021 0.2634818200000026
0.6225045600000030 0.3423674699999992 0.2898472099999978
0.6094731900000028 0.2745833600000012 0.4769582600000035
0.5041161799999969 0.4122927200000035 0.4185185500000017
0.5219272799999999 0.4009416399999992 0.5305171899999976
0.5063632299999981 0.3305338500000019 0.4654395900000026
0.5009892799999989 0.1844271900000010 0.2632493600000032
0.5010783700000019 0.2616966800000000 0.2045298299999985
0.4898991600000002 0.2604365799999968 0.3206370999999990
0.5891771499999976 0.1611528299999989 0.3835487899999990
0.5877293799999990 0.2071317199999996 0.1529181800000003
0.6707811300000017 0.4618666900000008 0.5407550099999980
0.6804886600000017 0.4902515200000011 0.3834508999999997
0.6122317199999969 0.6615296499999985 0.6042275100000012
0.6233826799999989 0.5463897799999984 0.6593865099999974
0.5596257500000021 0.6245294499999972 0.4158119100000022
0.6263253099999986 0.6942126200000018 0.4262953599999975
0.6040828699999992 0.5675679599999981 0.2684745999999976
0.6521265700000001 0.6096691400000012 0.2741986500000024
0.7138545800000031 0.5820366299999975 0.6516421199999982
0.7094447799999983 0.6581813100000034 0.6066418699999971
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