iterations/neb0_image02_iter2_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
0.3511065699999989 0.5550849700000029 0.4218893399999999
0.3637038600000011 0.4461162999999999 0.5683400200000008
0.4554191100000011 0.5396015500000004 0.4114285799999990
0.5908553000000012 0.3275742399999970 0.3099760799999984
0.5268229799999986 0.3698430399999992 0.4635907199999991
0.5140022200000018 0.2278832100000017 0.2684266899999983
0.3320678799999968 0.5220814899999979 0.5329460499999996
0.4063468399999977 0.5972015799999966 0.4177049700000026
0.2268184699999978 0.5057062799999983 0.5556191100000021
0.1711325200000005 0.4226324300000002 0.6788953900000010
0.2227738699999975 0.3569756300000009 0.5231148700000006
0.5860785599999971 0.3611410999999976 0.4269569200000021
0.5749042699999976 0.2384877300000028 0.2920655599999975
0.6524563600000022 0.4810266799999994 0.4606356999999974
0.6432153499999984 0.5896585400000021 0.5980161000000024
0.6130741500000028 0.6157635200000016 0.4082405899999983
0.3353092899999979 0.5823540900000026 0.6082111999999995
0.2791498500000031 0.5000935400000017 0.5250098100000002
0.4079456999999991 0.6416235599999993 0.5128000999999998
0.4066684699999996 0.6480902999999998 0.3299176399999979
0.6147049400000029 0.3120701900000000 0.4949830700000035
0.6087270700000005 0.4361800000000002 0.4319820899999982
0.5901859800000011 0.1998561400000014 0.3863385499999978
0.6046223800000021 0.2014920200000034 0.2121783400000012
0.2071691000000015 0.4269870099999977 0.5870514100000008
0.2239922500000020 0.3693405400000032 0.4094993599999981
0.1236261399999989 0.4709663900000010 0.6717151799999996
0.6369609400000016 0.5621084400000029 0.4877019300000001
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0.3506579700000003 0.5146519199999986 0.3718560000000011
0.3261739399999968 0.5922568599999991 0.3998907900000006
0.3590960399999972 0.6144868900000020 0.5951549700000029
0.3603829500000018 0.4051185399999966 0.5198418599999997
0.3510290999999981 0.4280597300000011 0.6328437499999993
0.3994158699999986 0.4570938499999997 0.5766333099999983
0.4871990899999972 0.5672502999999978 0.4106540200000026
0.4539926699999981 0.5090114699999972 0.3504570699999974
0.4563832500000018 0.5054398700000036 0.4688597999999971
0.4332030099999997 0.6709281199999992 0.5230874000000014
0.4350105099999979 0.6568995599999994 0.3011465399999977
0.2210303700000011 0.5513518400000024 0.6336330999999973
0.2012940400000005 0.5322505999999976 0.4779217199999977
0.1582409900000030 0.3509357800000004 0.6870290900000029
0.1941683599999990 0.4469703899999971 0.7607969199999971
0.2686994299999981 0.3352861700000034 0.5480252600000028
0.1896395500000025 0.3035570999999990 0.5433903599999965
0.2504252800000017 0.3933428300000017 0.3815599100000000
0.1955170600000002 0.3800068299999992 0.3754927499999994
0.1234281899999985 0.5185525699999971 0.6954964099999970
0.1009525899999986 0.4650316299999986 0.6219509700000003
0.5714397200000008 0.3593423499999986 0.2640330400000011
0.6261826799999994 0.3327198799999991 0.2903860600000030
0.6131539699999990 0.2649303199999977 0.4774998800000034
0.5077073599999977 0.4028188599999964 0.4190338699999998
0.5256083100000026 0.3913227500000005 0.5311077900000001
0.5100360200000011 0.3209340100000020 0.4659729299999995
0.5046653599999971 0.1747800899999987 0.2637702099999970
0.5047716400000013 0.2520660100000001 0.2050507200000027
0.4935796700000026 0.2508122099999994 0.3211538700000034
0.5928427400000018 0.1515098400000028 0.3840915999999979
0.5914130700000015 0.1974800899999991 0.1534575100000026
0.6744622900000010 0.4522131399999978 0.5412775200000013
0.6841889199999969 0.4805989199999985 0.3839890699999984
0.6159370700000011 0.6519154699999987 0.6048158600000022
0.6270824799999986 0.5367427099999986 0.6600428799999989
0.5633409000000000 0.6148485800000003 0.4164059100000017
0.6300055199999974 0.6845385499999992 0.4269290200000029
0.6078106399999967 0.5579725799999977 0.2691304900000020
0.6557486499999996 0.6000294400000001 0.2748364799999976
0.7175985800000007 0.5723160200000024 0.6522241799999975
0.7131772500000011 0.6486226000000030 0.6071057999999994
0.00000000E+00 0.00000000E+00 0.00000000E+00
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