iterations/neb0_image01_iter29_CONTCAR output for 3: !!! 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
terminated
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
0.2025537399999990 0.5292012299999982 0.3056155000000018
0.2544549699999976 0.3989428499999974 0.2568655700000022
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0.2564406899999980 0.4921202399999984 0.2637581700000027
0.1558357299999997 0.5376521199999971 0.2246717399999980
0.3479223699999991 0.5413592800000018 0.3398728700000007
0.4371185299999993 0.4769299100000026 0.3407440000000008
0.3622868100000005 0.4242771999999988 0.4643377599999994
0.6182113999999999 0.5728227999999973 0.4591980300000031
0.6553266700000009 0.7233603099999968 0.4620899299999977
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0.1802872299999976 0.5633906899999985 0.1302941200000021
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0.2435094699999993 0.5454418200000006 0.1351974600000005
0.2492957999999987 0.3759416299999998 0.3227072399999997
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0.0977417900000006 0.4642134300000009 0.1568633700000035
0.1087058700000014 0.4402855599999995 0.2691153999999969
0.1466340200000005 0.4181279100000026 0.1833130799999978
0.1618043900000004 0.5866296199999965 0.0872024900000028
0.0921072499999980 0.5863703099999995 0.2777127299999975
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0.3467508800000019 0.6002465199999989 0.4009617800000029
0.4610819399999997 0.4243838499999981 0.3932417299999997
0.4391845000000032 0.4595850199999987 0.2439187700000005
0.3308262400000004 0.3751465599999975 0.4239807700000000
0.4017582299999987 0.3900171000000014 0.5035554099999970
0.3014847800000027 0.4784897999999984 0.5386933600000035
0.3490842100000009 0.4925028999999981 0.5936736499999995
0.4819635200000008 0.5715641999999974 0.3008535600000002
0.4649801999999994 0.5788344500000022 0.4068943700000034
0.6535928899999988 0.6382388899999967 0.5801119699999973
0.6917604900000001 0.6180117400000000 0.4944945800000013
0.6282243200000011 0.6234199100000026 0.3276139199999974
0.5611459499999967 0.5690306099999987 0.5804327000000029
0.5389830900000021 0.5419495699999999 0.4765099099999972
0.5465968099999969 0.6288474899999983 0.4973523299999982
0.6069738999999998 0.8242247299999974 0.4774896099999992
0.6098153200000027 0.7793051499999990 0.5797880200000023
0.5756422700000030 0.7496422099999975 0.4917454799999987
0.6591294899999980 0.7499489400000030 0.3136759300000023
0.7032611699999975 0.7997733500000024 0.5225284500000029
0.6600518500000021 0.4151465999999999 0.3588528599999989
0.6877148299999973 0.3997735499999990 0.5103943800000010
0.5418099400000003 0.2868788400000000 0.4179656800000018
0.5754386099999991 0.3616720099999995 0.3054993599999989
0.5412455100000031 0.4139037599999966 0.5863435400000014
0.5613626900000028 0.2951502800000014 0.5917493099999973
0.6202440400000029 0.4320370100000019 0.6818873499999967
0.6407123899999974 0.3543846700000017 0.6802075599999995
0.6431819800000014 0.2671639499999969 0.3034281300000004
0.6281141400000010 0.2182586899999990 0.3888922599999987
0.00000000E+00 0.00000000E+00 0.00000000E+00
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