iterations/neb0_image04_iter10_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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0.2622464399999984 0.3976197799999994 0.2694016599999998
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0.3568915099999970 0.4910572499999972 0.6062996200000015
0.4896303700000004 0.5701078700000011 0.3136201700000001
0.4722283199999993 0.5773951299999993 0.4184583199999992
0.6457958000000019 0.6395978600000021 0.5674883900000012
0.6839930800000005 0.6193262999999973 0.4819786500000021
0.6204436900000019 0.6248564500000029 0.3150440499999974
0.5535783600000030 0.5705074700000026 0.5682063400000033
0.5319337899999965 0.5432819500000008 0.4643493900000024
0.5390089699999976 0.6302751999999998 0.4848702800000027
0.5992151499999991 0.8256192799999980 0.4648772399999999
0.6020253000000011 0.7806940299999994 0.5672422399999988
0.5679003899999984 0.7510294400000035 0.4791044799999966
0.6512858399999999 0.7513509400000018 0.3011194300000000
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0.6522805500000004 0.4165744399999980 0.3461670100000021
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0.5340840599999979 0.2882188000000028 0.4053351700000007
0.5676686400000008 0.3630637400000012 0.2928963199999970
0.5335235699999998 0.4154861999999966 0.5737635600000033
0.5535404099999965 0.2966398599999991 0.5792035600000034
0.6125228499999977 0.4334737200000021 0.6693868199999997
0.6329730900000001 0.3557784200000000 0.6676006300000026
0.6354856700000013 0.2685797199999982 0.2909242799999987
0.6204036800000026 0.2197186200000019 0.3764363000000017
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