iterations/neb0_image02_iter21_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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0.1583688799999976 0.5371990599999990 0.2288718499999973
0.3504931000000013 0.5409117700000010 0.3441053199999971
0.4396581999999967 0.4764143499999989 0.3448090099999988
0.3648780600000023 0.4238300700000011 0.4685118800000012
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0.6459811699999989 0.4206886400000016 0.4513682199999991
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0.3040927999999994 0.4780802000000008 0.5429359299999987
0.3516969000000003 0.4920372400000019 0.5979062099999979
0.4845217199999965 0.5710913099999999 0.3050275499999984
0.4674204900000021 0.5783543900000012 0.4108558100000010
0.6509879199999986 0.6386450899999971 0.5758898300000013
0.6891888999999978 0.6183803200000000 0.4903527199999971
0.6256247299999984 0.6238944500000017 0.3234598100000028
0.5586488000000003 0.5695050400000028 0.5763105099999990
0.5365307100000010 0.5424108200000006 0.4723157199999974
0.5440836100000013 0.6293528499999965 0.4931805800000006
0.6044059000000033 0.8246522600000006 0.4733009899999985
0.6072063100000022 0.7797673000000032 0.5756784599999989
0.5730990200000008 0.7500804000000016 0.4875298600000022
0.6564755400000024 0.7503727900000001 0.3095520600000015
0.7007008599999978 0.8001853000000025 0.5182614799999996
0.6574528499999985 0.4155943499999992 0.3545710400000033
0.6851090400000004 0.4002953700000020 0.5061286700000025
0.5392958400000012 0.2873333200000019 0.4137819899999968
0.5728860500000010 0.3621195999999998 0.3013871300000019
0.5386987400000010 0.4145017199999970 0.5822136399999991
0.5587489700000035 0.2956699400000034 0.5876586300000000
0.6176801200000028 0.4324680000000001 0.6777983100000000
0.6381345200000013 0.3548520900000014 0.6760172199999985
0.6406636000000034 0.2676296799999989 0.2992873800000027
0.6255754999999965 0.2187382600000021 0.3847904100000008
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