iterations/neb0_image09_iter55_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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0.2825548699999985 0.3932994199999982 0.3034362200000018
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0.1828285200000010 0.5330458500000006 0.2695736599999989
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0.3838904699999972 0.4100009000000000 0.5091519599999970
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0.3405825099999973 0.6185141599999966 0.2545689199999970
0.6558570999999986 0.6542307300000019 0.5320915599999978
0.7051595599999985 0.6612555499999999 0.4727472100000014
0.5863099399999996 0.6207341499999970 0.3062647699999985
0.6016170099999982 0.6253822999999983 0.6299456799999987
0.6083568399999990 0.5181776200000030 0.6164031799999989
0.5475391000000016 0.5771916300000015 0.5234939899999986
0.5805146100000016 0.8250237099999964 0.4303989000000001
0.5826767399999966 0.7831742300000002 0.5327045699999999
0.5504890099999997 0.7519052000000030 0.4441423399999991
0.6296030399999992 0.7560779499999981 0.2604176199999984
0.6779832900000002 0.8170597200000032 0.4786897700000026
0.6318910900000034 0.4154045699999998 0.3135413099999980
0.6627992100000029 0.3947963299999984 0.4635751799999994
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0.5471298499999975 0.3667264500000016 0.2624677000000020
0.5182403299999976 0.4189192300000002 0.5630627999999973
0.5342882400000022 0.2985596400000006 0.5470887600000012
0.5930902200000006 0.4355005999999975 0.6413776400000017
0.6193006900000029 0.3587679399999999 0.6410066500000013
0.6144543899999988 0.2719917499999980 0.2558503999999999
0.5990388800000019 0.2211267899999996 0.3393530199999972
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