iterations/neb0_image05_iter12_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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0.2068517000000014 0.5177318200000016 0.4786688800000007
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0.2010526999999982 0.3654902399999997 0.3762962599999966
0.1290081799999996 0.5040594399999989 0.6963038800000021
0.1065196200000003 0.4504655699999986 0.6227745200000001
0.5658832000000018 0.3738862599999990 0.2631968199999974
0.6206215099999994 0.3472573900000029 0.2895797600000023
0.6076106599999989 0.2794577599999997 0.4766836100000020
0.5027667700000009 0.4162042499999998 0.4182140500000031
0.5201007799999999 0.4056976899999967 0.5300797900000020
0.5045464900000027 0.3350080900000023 0.4652853899999982
0.4991426799999985 0.1893124599999965 0.2630101499999995
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0.5873373599999994 0.1660712999999987 0.3832567800000035
0.5858680099999987 0.2120238700000030 0.1526397599999996
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0.5576995799999978 0.6294668399999992 0.4154528700000029
0.6244391999999976 0.6991204199999999 0.4258677400000010
0.6022099500000024 0.5725390500000032 0.2681468800000033
0.6501684400000016 0.6145441800000029 0.2739280999999991
0.7120349300000015 0.5868503399999980 0.6514090299999964
0.7076026599999992 0.6631553599999975 0.6063695400000029
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