iterations/neb0_image07_iter30_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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0.6115551199999985 0.6259168599999967 0.3019674299999977
0.5492161199999970 0.5753486699999968 0.5635857500000014
0.5310303999999988 0.5409068800000014 0.4591382899999985
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0.5909835599999980 0.8270316699999967 0.4514527400000006
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