iterations/neb0_image06_iter64_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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0.6456080499999999 0.6440109799999973 0.5545740399999985
0.6883600000000030 0.6313150300000032 0.4748868799999997
0.6087259900000035 0.6239437099999989 0.3066925400000002
0.5665571400000005 0.5879628900000000 0.5864624199999966
0.5456572800000004 0.5314079600000028 0.5032366499999981
0.5375515100000001 0.6188979100000012 0.4909153799999970
0.5916216000000034 0.8261972399999991 0.4510811399999994
0.5946658900000017 0.7820015400000031 0.5529959699999978
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0.6878958200000014 0.8062524899999985 0.4984682099999986
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0.5259779499999979 0.4159138899999988 0.5647772499999988
0.5459286899999967 0.2974697399999968 0.5666135499999996
0.6043329900000032 0.4346555099999989 0.6580638000000008
0.6259731399999993 0.3575548499999996 0.6560213899999994
0.6267450300000021 0.2698275099999989 0.2767026499999972
0.6114584999999977 0.2199923699999999 0.3608280500000021
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