iterations/neb0_image07_iter46_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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0.6408580000000015 0.6431173799999996 0.5468590300000002
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0.5881247399999978 0.8270935099999974 0.4460189799999981
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0.6082303499999995 0.2210105200000001 0.3542103699999970
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