iterations/neb0_image05_iter23_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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0.1065739599999986 0.4503707499999976 0.6228366899999997
0.5658570200000028 0.3740092399999995 0.2632486099999980
0.6206114100000022 0.3473515900000024 0.2895049400000005
0.6076395099999985 0.2794231299999979 0.4767208199999970
0.5030817399999989 0.4155658800000026 0.4176780199999968
0.5201556600000004 0.4055186900000010 0.5301991999999984
0.5046898000000013 0.3343384599999979 0.4656241200000011
0.4991527399999995 0.1893779299999991 0.2630517200000000
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0.4880053899999979 0.2653356900000006 0.3204647600000001
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0.5858476900000014 0.2121245700000003 0.1526279300000013
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0.5576265899999981 0.6296183899999974 0.4153955999999965
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0.6021090999999998 0.5727048800000034 0.2680488800000020
0.6500964999999965 0.6146311400000002 0.2739522700000023
0.7120473700000005 0.5869191600000008 0.6514220999999978
0.7076197499999992 0.6633023999999992 0.6064505100000019
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