iterations/neb0_image03_iter18_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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0.3655599000000009 0.4412535299999973 0.5686568300000019
0.4572348399999981 0.5348928200000032 0.4116809399999966
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0.4081638799999965 0.5924733399999980 0.4179382900000022
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0.4558052000000004 0.5042504600000015 0.3507591600000026
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0.2031744399999980 0.5274268699999993 0.4781703100000030
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0.2522938099999976 0.3885256299999966 0.3817830699999973
0.1973490900000030 0.3752167900000032 0.3757396600000007
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0.1028162100000003 0.4601988100000014 0.6222650200000004
0.5695975399999966 0.3641874599999966 0.2637672400000000
0.6243353200000001 0.3375606999999974 0.2901270199999999
0.6113200300000017 0.2697807500000025 0.4772210000000001
0.5059566999999987 0.4075047600000019 0.4187092499999991
0.5237507100000016 0.3961128700000032 0.5308207100000004
0.5081940900000035 0.3256628600000013 0.4656911000000008
0.5028624799999974 0.1795819399999985 0.2635559400000034
0.5028801999999999 0.2568593199999967 0.2048130700000002
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0.5910626699999995 0.1563954100000018 0.3837795800000023
0.5895652000000027 0.2023313700000031 0.1531191899999982
0.6726336300000000 0.4570742100000018 0.5410175700000011
0.6823158500000019 0.4854427499999971 0.3836758599999968
0.6140591599999965 0.6566191200000020 0.6043224100000018
0.6252071199999989 0.5415791799999994 0.6593603700000017
0.5613968400000005 0.6198177699999974 0.4160346199999978
0.6281708100000003 0.6893968999999984 0.4263811100000012
0.6058699100000027 0.5628873699999986 0.2686969399999981
0.6539020499999992 0.6048434799999995 0.2744820300000015
0.7157194600000025 0.5771800200000001 0.6519310799999971
0.7112889799999991 0.6534023399999995 0.6069809399999997
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