iterations/neb0_image01_iter41_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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0.1033751499999980 0.4501777799999971 0.2720726000000013
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0.4778291100000018 0.5799123099999974 0.4020916799999981
0.6603089400000002 0.6467119200000013 0.5797322800000018
0.6938848699999980 0.6424223300000023 0.4858507300000028
0.6282279099999997 0.6200126199999971 0.3250018600000004
0.5466356700000006 0.5772236500000005 0.6001157299999988
0.5367445099999983 0.5371159999999975 0.4960547100000028
0.5384171099999975 0.6199663499999986 0.5018434999999997
0.6037864299999995 0.8336229399999979 0.4735849200000004
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0.5718398799999989 0.7606207700000027 0.4988569300000023
0.6694791600000016 0.7534435600000009 0.3032443499999999
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0.6610296899999994 0.4194914999999995 0.3697881499999980
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0.5384324199999995 0.3035909399999994 0.4167352999999991
0.5737852099999969 0.3667111999999975 0.3052803499999968
0.5309534000000014 0.3924790399999978 0.5945344200000022
0.5702060099999997 0.2758598599999971 0.5855899399999984
0.6147295399999990 0.4357148599999974 0.6679575000000000
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0.6297183499999974 0.2696577199999979 0.2870540099999985
0.6154994999999985 0.2106679199999988 0.3678919099999973
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