iterations/neb0_image02_iter60_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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0.1584011500000031 0.5370458000000013 0.2291033999999996
0.3507841899999988 0.5411882399999968 0.3447765499999988
0.4396473700000030 0.4757213999999976 0.3439257499999968
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0.4664236699999975 0.5784576900000005 0.4085804699999969
0.6516488199999984 0.6391143099999965 0.5756536100000034
0.6896690299999975 0.6199184700000018 0.4891455400000027
0.6248077999999992 0.6233450499999975 0.3238522899999978
0.5587199799999993 0.5706978300000003 0.5794850899999986
0.5376599399999975 0.5410416799999993 0.4758405999999979
0.5439765899999998 0.6284761599999982 0.4939641599999973
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0.5726858299999975 0.7507983300000021 0.4879518500000017
0.6565974299999979 0.7500787199999976 0.3088983999999968
0.7004200699999998 0.8008871600000020 0.5178004200000004
0.6576106400000015 0.4159128000000010 0.3550960000000032
0.6854651399999980 0.4007312999999968 0.5065018600000002
0.5391753899999969 0.2887514199999970 0.4139480899999981
0.5731628400000019 0.3631162900000007 0.3011233399999966
0.5383022899999972 0.4124885100000029 0.5828441999999967
0.5596870600000017 0.2944944699999965 0.5874553900000024
0.6170836699999995 0.4334634699999995 0.6779633000000018
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0.6397722999999971 0.2671608200000009 0.2974136999999999
0.6242899300000033 0.2180027499999966 0.3814438899999999
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