./iterations/neb0_image08_iter12_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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0.6351693100000020 0.6414951000000002 0.5501516300000020
0.6736093600000004 0.6213555400000033 0.4648179200000015
0.6097517500000009 0.6266664899999981 0.2980395399999978
0.5437906000000012 0.5727918700000032 0.5545445699999973
0.5269611299999966 0.5439011100000002 0.4519979199999966
0.5292331300000015 0.6314569000000034 0.4685024699999971
0.5886220000000009 0.8275460199999998 0.4477341999999993
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0.5230339499999985 0.4174613799999989 0.5570923399999970
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