iterations/neb0_image03_iter1_CONTCAR output for 43: 3.6A-->1.6A 715(amd-3) Si-CH2H...H2HC-Si two dimer closed (TSS)
Status:
finished
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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0.3655447699999996 0.4413003200000034 0.5686076499999970
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0.2522665300000000 0.3885265400000009 0.3818276900000015
0.1973581700000011 0.3751904599999989 0.3757603600000010
0.1252692099999990 0.5137362500000009 0.6957642899999996
0.1027936999999994 0.4602154000000027 0.6222187600000026
0.5695986300000015 0.3641585700000007 0.2637654899999973
0.6243414699999974 0.3375362199999969 0.2901182800000015
0.6113127899999995 0.2697463599999992 0.4772321800000014
0.5058663399999972 0.4076349799999974 0.4187663100000023
0.5237672299999971 0.3961390999999992 0.5308400999999989
0.5081948699999970 0.3257502399999979 0.4657053899999966
0.5028241099999988 0.1795965600000002 0.2635022500000019
0.5029305799999975 0.2568825199999978 0.2047825900000007
0.4917384499999997 0.2556288199999983 0.3208859399999966
0.5910013000000021 0.1563260400000033 0.3838239000000030
0.5895719600000007 0.2022963000000004 0.1531900299999975
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0.6823480400000008 0.4854149100000029 0.3837216900000016
0.6140965800000018 0.6567319600000019 0.6045490200000003
0.6252418999999989 0.5415595300000007 0.6597765599999974
0.5614993200000029 0.6196644799999973 0.4161394500000029
0.6281641599999972 0.6893548800000033 0.4266634800000020
0.6059703900000031 0.5627893699999973 0.2688645200000011
0.6539068200000031 0.6048455700000019 0.2745700099999979
0.7157580900000013 0.5771312399999999 0.6519573200000011
0.7113365200000032 0.6534400700000020 0.6068373499999993
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