iterations/neb0_image02_iter28_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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0.1112795000000020 0.4397501899999980 0.2732843000000003
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0.1643434300000024 0.5861530700000017 0.0913866499999969
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0.4636628499999986 0.4239544599999974 0.3973502799999977
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0.3040907600000011 0.4780279800000002 0.5428763399999994
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0.4845589899999965 0.5710374399999978 0.3049441100000010
0.4673636200000004 0.5783485500000012 0.4107889699999987
0.6510055099999974 0.6386485700000009 0.5758792499999998
0.6892112900000029 0.6184510499999973 0.4902997100000022
0.6255968700000025 0.6238621400000000 0.3234768100000025
0.5586316999999994 0.5695658699999981 0.5764535300000020
0.5365948999999972 0.5423530200000002 0.4724554599999991
0.5440826999999970 0.6293178999999967 0.4932223599999972
0.6044052600000001 0.8246641200000013 0.4732985400000018
0.6071977200000021 0.7798113099999995 0.5756779700000010
0.5730811500000002 0.7501120100000023 0.4875557900000018
0.6564846899999992 0.7503665099999992 0.3095260600000032
0.7006852000000023 0.8001871800000018 0.5182147599999993
0.6574560600000012 0.4156139199999984 0.3546045800000002
0.6851489800000010 0.4003087800000031 0.5062057600000003
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0.5728957800000032 0.3621712899999991 0.3013629699999996
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0.5587957099999983 0.2956390599999992 0.5876787500000020
0.6176355699999974 0.4325008699999984 0.6777945600000024
0.6381294899999972 0.3548487199999997 0.6760533799999990
0.6406301800000023 0.2676118899999977 0.2992138700000027
0.6255335500000001 0.2186846099999968 0.3846750200000031
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