iterations/neb0_image02_iter74_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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0.6892135200000027 0.6185962400000022 0.4901114899999968
0.6253800900000002 0.6239007499999971 0.3236170799999982
0.5588300399999966 0.5697592100000008 0.5770083299999982
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0.6251618800000003 0.2183933199999970 0.3842779300000032
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