iterations/neb0_image03_iter3_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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0.1609715399999985 0.5367405499999975 0.2330357700000008
0.3530628500000006 0.5404596899999987 0.3482680899999977
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0.3674194199999974 0.4233358500000008 0.4726792700000004
0.6130425200000005 0.5737411300000019 0.4507585899999995
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0.4662621399999978 0.4235809899999978 0.4016531299999997
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0.3066812799999994 0.4776354700000027 0.5471538500000008
0.3543174799999989 0.4915340599999993 0.6021019800000005
0.4870827499999990 0.5706527899999969 0.3092042800000030
0.4700234199999969 0.5778722100000024 0.4151308200000017
0.6483863099999994 0.6391240600000003 0.5717532099999971
0.6865809299999981 0.6187748400000004 0.4862159300000002
0.6230673000000024 0.6243969200000024 0.3192808399999976
0.5561114899999993 0.5699278199999966 0.5719270199999968
0.5339009500000031 0.5429397199999997 0.4680357100000023
0.5415110200000015 0.6298693999999969 0.4889595900000003
0.6018318799999989 0.8251070299999981 0.4691473999999971
0.6046426600000032 0.7801980400000019 0.5714628599999969
0.5705140800000024 0.7505074500000006 0.4833250699999994
0.6538888899999975 0.7508676799999989 0.3053912600000004
0.6981296100000023 0.8006271499999968 0.5140967500000002
0.6548886200000013 0.4160632600000014 0.3503855399999978
0.6825260600000007 0.4007410500000006 0.5019159799999997
0.5366848199999978 0.2877083999999996 0.4096090399999994
0.5702910999999986 0.3625855000000016 0.2971461599999969
0.5361583700000025 0.4150253999999975 0.5779294600000000
0.5561330299999980 0.2962211400000001 0.5834476400000028
0.6151306000000005 0.4329767400000009 0.6736454099999989
0.6355657300000033 0.3552796700000016 0.6717902299999992
0.6381180899999990 0.2680907100000027 0.2952053699999979
0.6230479000000031 0.2192645499999983 0.3807040800000010
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