iterations/neb0_image07_iter43_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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0.2741565399999999 0.4888109899999975 0.2930354499999979
0.1740980399999970 0.5345392799999971 0.2541186500000023
0.3649664799999996 0.5383673299999998 0.3680622500000013
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0.1161614299999982 0.4611257600000016 0.1865056500000009
0.1270611799999983 0.4373762099999965 0.2989204400000034
0.1649201500000004 0.4145874599999999 0.2132400300000015
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0.1101789399999973 0.5818272500000035 0.3084074400000034
0.3811051200000009 0.5575482799999989 0.2789698200000004
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0.3195227599999981 0.4754705000000001 0.5688312199999999
0.3667765900000006 0.4895023600000030 0.6237619500000022
0.4875719099999998 0.5609152700000024 0.3180202899999998
0.4334930400000019 0.5843826999999990 0.3818965299999988
0.6381427500000001 0.6418428300000016 0.5484746400000020
0.6836519900000013 0.6277456999999984 0.4676204399999975
0.6070673700000029 0.6245509099999964 0.3000824900000012
0.5607974699999971 0.5868689099999997 0.5926241199999964
0.5616180800000024 0.5283612699999978 0.4935298700000033
0.5370804100000015 0.6229135999999968 0.4831853900000027
0.5888284799999965 0.8272300799999996 0.4475241100000034
0.5915523500000006 0.7828312600000018 0.5502206700000016
0.5573301800000010 0.7532944499999985 0.4621306100000027
0.6404994199999976 0.7529137499999976 0.2827356399999985
0.6851716099999976 0.8047867100000019 0.4930435099999997
0.6416809700000030 0.4183352100000022 0.3287016000000023
0.6701818399999979 0.4026886400000009 0.4813540299999985
0.5238116900000023 0.2901291900000018 0.3887306100000032
0.5572304200000033 0.3651759099999978 0.2764672799999985
0.5236260699999988 0.4172540400000031 0.5621189900000019
0.5431012900000027 0.2977617000000023 0.5626708899999997
0.6016879900000021 0.4348603099999977 0.6531335100000035
0.6233069199999974 0.3575204400000018 0.6517060199999989
0.6245902699999988 0.2702695799999972 0.2731340899999992
0.6093956400000025 0.2208253900000017 0.3574252900000019
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