iterations/neb0_image07_iter41_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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0.7935165100000034 0.6859573099999992 0.5870342799999975
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0.4140588500000035 0.4850871599999991 0.7323692100000017
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0.6450681999999972 0.6634519200000000 0.4033546599999980
0.8478049200000015 0.7902436299999991 0.4294020700000019
0.4790651200000013 0.5851740700000008 0.2478137399999980
0.8952279900000022 0.9204073300000033 0.4163689800000014
0.4036334800000034 0.1711262099999971 0.4519590399999984
0.6673344499999985 0.4171360400000026 0.7287719300000006
0.5285373899999968 0.8324029899999985 0.3372493500000004
0.5296353600000003 0.7992117200000024 0.4488806600000004
0.4936078200000011 0.7727560299999965 0.3612533000000013
0.5715904099999989 0.7564779799999997 0.1482842699999978
0.6266609199999991 0.8566900599999983 0.3955881899999980
0.5769752599999975 0.4254938600000031 0.2174963699999992
0.6250979599999980 0.4015538700000008 0.3943302500000030
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0.4730258900000024 0.4255044100000021 0.5811285999999996
0.4823593699999975 0.2892470199999977 0.4710249199999978
0.5322448900000012 0.4316386499999965 0.5673377199999976
0.5798216100000033 0.3670055400000010 0.5760528300000018
0.5524595099999985 0.2771739399999973 0.1521567699999977
0.5341141500000006 0.2132148600000008 0.2108321600000025
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