iterations/neb0_image08_iter45_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
0.2243591800000004 0.5252239699999990 0.3410731900000030
0.2765522999999988 0.3946911299999982 0.2929693099999966
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0.6489951300000030 0.6449406999999994 0.4716877700000026
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0.1780126800000019 0.5336960699999977 0.2602311099999994
0.3680429699999976 0.5374256899999992 0.3734729399999992
0.4454707100000022 0.4642763800000012 0.3459217999999993
0.3825810399999980 0.4185599899999985 0.5019241399999999
0.6110608999999982 0.5824100500000000 0.4384760200000031
0.6359556199999972 0.7296493500000025 0.4251074100000025
0.6275986400000022 0.4228361400000011 0.4208175999999995
0.5617681499999989 0.3225312499999973 0.3504183299999966
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0.2906376899999970 0.5194108600000007 0.2006415000000032
0.3159925799999996 0.5110905800000012 0.3718777899999992
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0.2656374399999990 0.5413777799999977 0.1702817299999992
0.2712461200000007 0.3713953299999986 0.3584347600000015
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0.1198779099999996 0.4605144900000013 0.1925899700000002
0.1307604499999968 0.4366939100000025 0.3048826699999978
0.1685190999999975 0.4137785100000002 0.2191686999999973
0.1835012599999999 0.5828439300000028 0.1230403300000020
0.1140676999999997 0.5812290800000000 0.3141514599999979
0.3836655200000010 0.5565680099999994 0.2840217299999992
0.3694583699999967 0.5958905700000017 0.4368940700000010
0.4822670799999997 0.4367338599999968 0.4152310899999989
0.4559737100000021 0.4318571399999982 0.2598769499999989
0.3513516900000013 0.3675150500000015 0.4623920299999966
0.4238079100000007 0.3859991599999972 0.5388506299999989
0.3233240599999974 0.4749620500000020 0.5752609299999989
0.3704539000000011 0.4888767999999999 0.6301527199999981
0.4846164100000010 0.5612553300000016 0.3179406400000033
0.4211943999999974 0.5872480600000003 0.3720451000000011
0.6357193899999984 0.6428524600000003 0.5418836200000001
0.6839871299999984 0.6308048300000024 0.4632235999999992
0.6023114400000011 0.6246993999999972 0.2951293899999996
0.5621866099999977 0.5920073899999991 0.5975595499999997
0.5687998499999978 0.5247884999999997 0.5000148399999986
0.5359080699999978 0.6196183699999978 0.4813057200000017
0.5851055199999990 0.8277530299999967 0.4411874999999981
0.5878910500000032 0.7833618499999986 0.5436216700000003
0.5537270700000008 0.7537322299999971 0.4556054299999985
0.6366912399999975 0.7538013799999987 0.2762246500000032
0.6816766000000030 0.8063043200000024 0.4873961699999967
0.6379868000000002 0.4184748099999993 0.3221558600000023
0.6666286499999998 0.4025924999999972 0.4753107100000022
0.5197903299999993 0.2906116400000016 0.3827538700000019
0.5532371400000002 0.3658933899999965 0.2705902300000034
0.5205348699999988 0.4179802800000019 0.5581335500000009
0.5391629900000012 0.2983096800000027 0.5564492600000008
0.5979412499999981 0.4354694900000027 0.6469911499999981
0.6199033799999967 0.3580872200000016 0.6460702099999978
0.6206767700000029 0.2710591800000017 0.2673035199999987
0.6055790599999966 0.2216790100000026 0.3514231400000014
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