iterations/neb0_image09_iter26_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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0.3852292300000002 0.5570861599999972 0.2844367800000001
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0.4597860299999965 0.4490581800000015 0.2720498999999990
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0.3707988399999991 0.4887038800000028 0.6292329699999968
0.4971278000000012 0.5653207499999979 0.3301409199999981
0.4665416500000035 0.5778328199999976 0.4220896200000013
0.6324153099999990 0.6418828300000001 0.5439817999999974
0.6741922100000011 0.6237180199999983 0.4602175200000005
0.6056744300000005 0.6269723099999993 0.2928706699999992
0.5456525299999981 0.5781085899999994 0.5616872100000023
0.5342665599999989 0.5390778599999990 0.4566825200000011
0.5282441900000023 0.6301364199999995 0.4670479099999980
0.5854221800000019 0.8279148199999966 0.4423809399999996
0.5881767999999994 0.7832177700000003 0.5446748999999969
0.5540110600000006 0.7536039399999979 0.4566395700000001
0.6373353299999991 0.7537954299999967 0.2784678399999976
0.6816720899999993 0.8040867100000000 0.4875177300000004
0.6383992100000029 0.4190354200000002 0.3235581699999983
0.6662342500000022 0.4036739399999973 0.4754025299999967
0.5202980600000018 0.2906909200000030 0.3829336900000015
0.5538150000000002 0.3656140399999970 0.2707724500000026
0.5202619200000029 0.4180058600000010 0.5536417699999987
0.5396542499999981 0.2990593899999965 0.5568590999999969
0.5986403400000029 0.4359504600000008 0.6472084400000000
0.6195419100000024 0.3581384599999993 0.6457086300000014
0.6216104700000002 0.2710870100000022 0.2683414600000020
0.6065042600000012 0.2220857499999980 0.3537504600000005
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