iterations/neb0_image01_iter44_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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0.1241759299999998 0.4580224500000014 0.2069429200000030
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0.3480224300000003 0.5414460300000030 0.3397866800000031
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0.3624097200000023 0.4242511799999988 0.4642720900000015
0.6182309900000007 0.5729511600000023 0.4595527299999986
0.6553459000000004 0.7235480100000018 0.4618304099999975
0.6486770899999996 0.4203833700000033 0.4560259100000010
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0.3466932400000005 0.6000349799999967 0.4007653899999966
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0.4391547099999968 0.4595090799999966 0.2442271299999987
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0.3013867399999981 0.4782027500000012 0.5384144200000023
0.3487767100000028 0.4925944000000015 0.5934077200000019
0.4821066000000016 0.5714963100000006 0.3011064100000027
0.4653337499999992 0.5788774600000011 0.4067723100000009
0.6537755299999972 0.6384643700000012 0.5800964000000022
0.6918180099999987 0.6186716799999985 0.4942673799999966
0.6282269299999967 0.6233404700000023 0.3275350799999970
0.5607540800000024 0.5692521300000024 0.5809623500000001
0.5389250599999968 0.5418261499999986 0.4770373100000000
0.5463782899999998 0.6286011999999985 0.4974741699999967
0.6068867400000002 0.8244838800000025 0.4773775700000016
0.6098528200000004 0.7794921099999996 0.5797406300000034
0.5755411900000027 0.7499374599999982 0.4919354399999989
0.6594077900000030 0.7500460500000017 0.3133901899999998
0.7031743399999968 0.8000858199999996 0.5227565400000032
0.6600788800000004 0.4152620899999988 0.3591356399999981
0.6878619299999968 0.3996945399999987 0.5108805599999968
0.5417248299999997 0.2873320799999988 0.4179256800000033
0.5753939900000020 0.3618077200000016 0.3054903999999965
0.5409651399999973 0.4133344800000032 0.5865660899999980
0.5615977900000004 0.2946205499999976 0.5915874700000003
0.6200962200000006 0.4321332100000035 0.6815129299999967
0.6407024100000029 0.3545566399999984 0.6804570099999978
0.6428284099999999 0.2672356799999989 0.3029721899999984
0.6277714100000011 0.2180670500000019 0.3883169499999966
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