iterations/neb0_image07_iter28_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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0.4958008400000011 0.5669143399999967 0.3238553999999993
0.4717535400000017 0.5772537900000003 0.4237388299999978
0.6378349000000014 0.6410147400000028 0.5538108699999995
0.6775393400000027 0.6216952799999973 0.4689830499999985
0.6118019299999986 0.6260021699999996 0.3020066600000035
0.5484430599999968 0.5745449400000027 0.5624445999999992
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0.5322067700000019 0.6308204099999983 0.4740162699999999
0.5910562199999987 0.8270288499999978 0.4515984700000004
0.5938338599999966 0.7822280999999975 0.5539551900000035
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0.6430391199999974 0.7527578600000027 0.2877433600000003
0.6873237100000011 0.8028107900000023 0.4965829200000016
0.6440592399999971 0.4180943799999994 0.3329136999999989
0.6718414600000031 0.4027525600000033 0.4845903000000007
0.5259470299999975 0.2897065100000020 0.3922014300000001
0.5595082800000029 0.3645949200000018 0.2797771899999972
0.5254818700000001 0.4169753500000013 0.5614124700000005
0.5453484100000026 0.2981170099999986 0.5660466100000008
0.6042490099999966 0.4350051400000012 0.6563060800000002
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0.6121854100000022 0.2210745900000006 0.3628631200000001
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