iterations/neb0_image05_iter48_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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0.3587685899999968 0.5396566100000015 0.3582723399999992
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0.3750096999999997 0.5593388500000032 0.2686090099999987
0.3580482799999984 0.5982226900000001 0.4199396899999996
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0.4484296799999967 0.4494907600000033 0.2560022799999970
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0.3126493600000018 0.4764720900000015 0.5569906099999997
0.3600063199999965 0.4909307799999993 0.6121073199999998
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0.4596115399999974 0.5799371499999992 0.4068503900000024
0.6438647100000026 0.6407363200000020 0.5611620000000030
0.6847053299999999 0.6231189000000015 0.4768914300000020
0.6156742100000017 0.6244782300000011 0.3104169499999969
0.5567932800000008 0.5772640899999999 0.5780740399999971
0.5406005899999968 0.5377482700000016 0.4752259199999997
0.5383809499999970 0.6280292000000003 0.4859716400000025
0.5958000899999973 0.8264805700000011 0.4590348099999986
0.5986989900000026 0.7817635500000009 0.5614859499999980
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0.6478560600000023 0.7517912200000012 0.2944436100000019
0.6923122199999980 0.8024215200000029 0.5038701200000020
0.6488145100000011 0.4174710599999969 0.3405460800000029
0.6769390999999985 0.4020334100000014 0.4926336199999994
0.5305474099999969 0.2891988100000020 0.4003555099999971
0.5641955400000001 0.3641533899999985 0.2873671199999990
0.5299000600000028 0.4153965100000008 0.5699375200000034
0.5502665799999988 0.2969121200000018 0.5736067400000024
0.6083769899999965 0.4335657499999996 0.6636291800000009
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0.6315823899999984 0.2690479600000018 0.2844879800000015
0.6163892300000029 0.2191673399999985 0.3694825600000016
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