iterations/neb0_image08_iter24_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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0.3655227200000013 0.5968031000000025 0.4312864700000034
0.4796777099999971 0.4230419699999999 0.4220237299999994
0.4574713000000017 0.4532307099999997 0.2706893800000003
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0.4204580700000022 0.3866536700000012 0.5337261600000005
0.3201286400000001 0.4751960400000002 0.5690279000000018
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0.4977917200000022 0.5666846299999975 0.3289660800000007
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0.6350091999999989 0.6414752499999992 0.5493618499999968
0.6746407700000034 0.6220466400000007 0.4645292599999991
0.6091262500000028 0.6265237400000032 0.2976450299999982
0.5455247499999984 0.5747180600000021 0.5588737899999998
0.5306115300000016 0.5417542200000014 0.4552731100000003
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0.5883270499999966 0.8275433299999975 0.4471886600000019
0.5911222499999980 0.7827036300000003 0.5495122199999969
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0.6846256099999977 0.8032584700000029 0.4921796300000025
0.6413519600000015 0.4185825400000027 0.3285101900000029
0.6690960800000028 0.4032689300000030 0.4801696500000006
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0.5567654800000028 0.3650526999999997 0.2755203099999974
0.5228266399999981 0.4175159500000021 0.5571993800000001
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0.6015548900000027 0.4354142099999976 0.6518616500000007
0.6221788200000020 0.3577027500000014 0.6501144200000013
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0.6094664800000018 0.2216287199999982 0.3586075999999991
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