iterations/neb0_image04_iter67_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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0.3557089500000004 0.5402513299999967 0.3533577999999977
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0.3722376999999994 0.5604970699999967 0.2636370499999998
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0.3570603200000022 0.4909335299999995 0.6071093300000001
0.4890318699999980 0.5680517600000030 0.3107688699999969
0.4638005600000028 0.5800795800000031 0.4084786600000001
0.6472107499999993 0.6408820999999989 0.5664673899999997
0.6861752900000013 0.6222369500000013 0.4815476300000014
0.6186826900000000 0.6242078100000015 0.3150380299999966
0.5574978400000035 0.5741948300000033 0.5762665499999997
0.5361451400000021 0.5394709099999986 0.4757110600000019
0.5396719800000014 0.6279273099999969 0.4880505300000024
0.5986635599999985 0.8259493700000036 0.4631081400000028
0.6016597599999969 0.7811527900000002 0.5653335200000029
0.5673176600000005 0.7515139099999999 0.4776177899999965
0.6508336400000019 0.7514905700000014 0.2991178500000018
0.6949048299999987 0.8025775099999990 0.5095664899999974
0.6518942000000010 0.4167399600000010 0.3456993699999984
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0.5325715700000018 0.4145305400000012 0.5737551100000005
0.5535237899999998 0.2960715199999981 0.5780150100000014
0.6117632099999994 0.4336971899999966 0.6680438499999966
0.6324891100000016 0.3562895999999967 0.6669695900000008
0.6343642100000011 0.2687078499999984 0.2887112399999978
0.6189525300000014 0.2194600500000021 0.3737630800000034
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