iterations/neb0_image02_iter55_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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0.6515675099999996 0.6390086899999972 0.5756654899999987
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0.6248764799999975 0.6232534299999983 0.3238423100000034
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0.5439725100000032 0.6286202699999990 0.4939143000000001
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0.6244219299999969 0.2179306600000004 0.3819058400000017
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