iterations/neb0_image09_iter22_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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0.3227625500000002 0.4746269799999965 0.5733162399999969
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0.4737247400000015 0.5765593699999982 0.4281664599999999
0.6323638699999989 0.6418930099999969 0.5449574299999966
0.6721933899999968 0.6225677199999993 0.4602832699999979
0.6064531000000031 0.6269446100000025 0.2934356399999984
0.5430398199999971 0.5752575200000010 0.5554390300000023
0.5301791699999967 0.5420765499999973 0.4525036900000003
0.5275409500000023 0.6310933999999975 0.4654548899999966
0.5857208999999983 0.8279972300000011 0.4429624799999985
0.5885020300000008 0.7831655399999988 0.5452902600000016
0.5543669400000013 0.7535280399999991 0.4572075800000022
0.6377158800000018 0.7537620599999997 0.2791987700000007
0.6819895799999998 0.8037446499999987 0.4879808700000012
0.6387352400000026 0.4190316099999976 0.3242103099999980
0.6664476500000021 0.4037285200000014 0.4758549200000033
0.5205989600000009 0.2906516400000001 0.3834770300000017
0.5541574399999973 0.3655338700000001 0.2712312399999988
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0.5399831599999985 0.2990922600000019 0.5573805800000002
0.5989704300000014 0.4358469299999967 0.6476178400000023
0.6195814499999983 0.3582245799999981 0.6459349100000011
0.6219703699999997 0.2710550400000002 0.2689627000000030
0.6068716300000006 0.2221114099999966 0.3544545000000028
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