iterations/neb0_image07_iter26_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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0.1717710100000005 0.5347809399999974 0.2504905999999991
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0.6377849900000001 0.6409993500000013 0.5538987700000035
0.6772204099999968 0.6215016399999982 0.4689503399999992
0.6119218099999983 0.6260477599999987 0.3020289099999971
0.5480162200000009 0.5740909499999987 0.5617917499999976
0.5305482600000033 0.5418156799999991 0.4576295299999984
0.5321072500000028 0.6309837800000011 0.4736972500000007
0.5910833399999973 0.8270335599999967 0.4516574100000028
0.5938646899999966 0.7822180900000006 0.5540219800000017
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0.5453811699999989 0.2981158799999974 0.5661190200000021
0.6042955799999987 0.4349919900000003 0.6563551200000006
0.6249518899999984 0.3571396999999976 0.6545503299999993
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0.6122200000000007 0.2210958599999984 0.3629705199999975
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