iterations/neb0_image02_iter12_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
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0.3637016200000005 0.4460924999999989 0.5683587600000024
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0.3319823900000003 0.5220303799999968 0.5329721399999983
0.4063103900000016 0.5972144099999994 0.4177124599999971
0.2267598600000014 0.5056419599999984 0.5556252700000002
0.1711341000000033 0.4226936900000027 0.6789089000000033
0.2227753399999983 0.3569575799999996 0.5229787199999976
0.5860770500000001 0.3610547299999993 0.4269731400000012
0.5749177900000007 0.2385543400000003 0.2920258300000000
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0.3353497399999981 0.5823199200000033 0.6082289400000036
0.2791309600000034 0.5000385900000026 0.5249793099999991
0.4079500899999999 0.6416363599999997 0.5127887900000019
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0.6369540000000029 0.5620538000000010 0.4876440900000034
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0.3510315199999994 0.4280308399999981 0.6328673000000009
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0.4872022899999990 0.5672629600000008 0.4106703699999983
0.4539943099999988 0.5090221299999982 0.3504677700000016
0.4563865100000015 0.5054401299999967 0.4688739200000001
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0.2686917199999996 0.3352884099999969 0.5479798699999989
0.1896474500000025 0.3035784799999988 0.5433914700000031
0.2504148100000023 0.3933350799999999 0.3815416400000018
0.1955039600000035 0.3800272900000010 0.3754928000000035
0.1234463500000018 0.5185796800000020 0.6954858000000002
0.1009542500000009 0.4650224600000001 0.6219563900000011
0.5714392799999999 0.3593647699999991 0.2640190199999992
0.6261883900000029 0.3327250600000013 0.2903976599999964
0.6131654499999968 0.2649132299999977 0.4774708300000015
0.5077062200000029 0.4028414200000014 0.4190144900000021
0.5255986100000030 0.3913277400000013 0.5311178199999986
0.5100356700000006 0.3209681499999988 0.4659274099999990
0.5046984399999985 0.1747527400000024 0.2638046699999990
0.5047461400000017 0.2520338100000004 0.2050859100000011
0.4936006000000006 0.2507479399999966 0.3211827100000022
0.5929064099999977 0.1515221900000014 0.3840544600000015
0.5914195699999993 0.1975054899999975 0.1534435800000011
0.6744775200000035 0.4522373400000035 0.5413024699999980
0.6841487700000002 0.4806169499999982 0.3839828199999999
0.6159159999999986 0.6518323000000024 0.6046946399999982
0.6270683600000027 0.5367692399999981 0.6597506700000011
0.5632577699999999 0.6149531900000014 0.4163088700000017
0.6300341500000002 0.6845888100000010 0.4266980800000013
0.6077534000000000 0.5580414300000029 0.2690152899999987
0.6557233899999986 0.6000051400000004 0.2747700299999991
0.7175883700000014 0.5723257799999999 0.6522150799999977
0.7131891000000010 0.6486466200000010 0.6071427099999980
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