iterations/neb0_image09_iter35_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
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0.4563034500000001 0.4080784499999979 0.2501840899999976
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0.6356937700000032 0.6446924099999976 0.5298083099999999
0.6938076499999966 0.6416893700000017 0.4597998200000006
0.5930053599999994 0.6234109399999994 0.2896684899999968
0.5786284300000020 0.6107484099999994 0.6394161699999970
0.6161223599999985 0.5075196199999965 0.5508029900000011
0.5419946100000033 0.6049549100000036 0.4919000499999981
0.5800569299999978 0.8279338700000025 0.4322390399999989
0.5827429200000012 0.7840371899999994 0.5349962399999981
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0.6767361300000019 0.8104254699999984 0.4803948200000008
0.6327676599999990 0.4183977599999977 0.3123209900000035
0.6623470800000035 0.4018618099999998 0.4669415899999976
0.5147354100000001 0.2910990800000022 0.3738595000000018
0.5479830000000021 0.3669236799999993 0.2627294400000011
0.5178567900000033 0.4189145100000005 0.5591432399999974
0.5340767699999986 0.2986762800000022 0.5481178100000008
0.5930594100000022 0.4354783499999968 0.6394520200000002
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0.6154964099999987 0.2718651300000019 0.2580848099999997
0.6002255499999976 0.2220666699999967 0.3422503099999972
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