iterations/neb0_image09_iter13_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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0.6710615599999983 0.6219696799999994 0.4603442200000032
0.6069241900000009 0.6271065800000031 0.2936429900000022
0.5414801699999998 0.5735428999999996 0.5520174600000018
0.5280145799999971 0.5436006999999989 0.4505147799999989
0.5270411699999968 0.6315918999999965 0.4645303699999985
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0.5207430399999993 0.2906346099999979 0.3837505799999974
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0.6070470800000010 0.2221712899999986 0.3547766300000035
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