iterations/neb0_image01_iter62_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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0.2542053100000032 0.3982935699999999 0.2570580100000015
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0.6487316699999965 0.4206676700000003 0.4565131399999984
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0.3012558799999994 0.4774826800000014 0.5377637100000001
0.3484652799999992 0.4926993500000023 0.5931880600000028
0.4824590899999990 0.5712794700000003 0.3009399700000017
0.4656729399999975 0.5785631899999970 0.4069911500000032
0.6540167200000013 0.6391758700000025 0.5803498000000005
0.6918240700000027 0.6190339400000013 0.4939133999999967
0.6283845800000023 0.6229605799999973 0.3280855900000006
0.5607825299999973 0.5694267100000019 0.5812923599999991
0.5391303800000031 0.5414180799999997 0.4775299900000007
0.5463398899999987 0.6284552999999988 0.4972794999999977
0.6067092500000015 0.8248811899999993 0.4771539600000025
0.6101331699999974 0.7796479800000000 0.5788837799999982
0.5753879499999996 0.7502473899999984 0.4918315500000006
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0.7029525100000029 0.8005366599999988 0.5234312199999991
0.6602725500000020 0.4156076000000013 0.3597938099999993
0.6877811199999968 0.3997164999999967 0.5112887299999969
0.5415936099999996 0.2880546700000011 0.4182362900000030
0.5753855099999967 0.3624530700000008 0.3055395100000027
0.5406602099999986 0.4122697299999984 0.5867998299999968
0.5620622300000022 0.2940414500000017 0.5914303500000031
0.6198682599999970 0.4323009499999984 0.6812708300000025
0.6405910800000001 0.3547671999999977 0.6806974100000005
0.6423707699999994 0.2672281700000028 0.3023579099999978
0.6272857200000033 0.2179068499999985 0.3874795500000019
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