iterations/neb0_image02_iter31_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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0.6459820099999973 0.4207133399999989 0.4514155399999993
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0.1112582900000021 0.4397541800000013 0.2732888900000034
0.1492281199999965 0.4176654400000004 0.1875224599999967
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0.3040793199999996 0.4779904999999971 0.5428299499999980
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0.4845719799999983 0.5709894800000015 0.3049332800000002
0.4673267100000018 0.5783624500000002 0.4107431999999989
0.6510246300000020 0.6386549699999975 0.5758541499999978
0.6892343000000025 0.6185078399999995 0.4902548399999986
0.6255765800000006 0.6238529199999974 0.3234781700000013
0.5586240399999980 0.5696107799999979 0.5765801200000027
0.5366489900000033 0.5423075300000022 0.4725803199999987
0.5440838499999998 0.6292736400000010 0.4932596000000018
0.6044019899999995 0.8246873699999995 0.4732894099999996
0.6071929499999982 0.7798462800000010 0.5756828199999973
0.5730683299999981 0.7501385099999993 0.4875756899999999
0.6564902599999982 0.7503531699999968 0.3095066899999992
0.7006748000000016 0.8002267899999964 0.5182212300000018
0.6574621000000036 0.4156206800000035 0.3545603499999999
0.6851681099999993 0.4003245199999981 0.5062189399999966
0.5392832200000015 0.2874517999999995 0.4138185099999987
0.5729006199999986 0.3622267100000016 0.3013146699999965
0.5386730900000032 0.4143388800000025 0.5823276300000018
0.5588165099999998 0.2955570399999985 0.5876826699999995
0.6176541199999974 0.4327562200000017 0.6778734499999999
0.6383221000000034 0.3546826299999992 0.6761814899999976
0.6405762099999990 0.2675894099999994 0.2991898499999976
0.6254662799999977 0.2187502800000019 0.3844646000000012
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