iterations/neb0_image01_iter19_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
0.2025025499999984 0.5292176399999988 0.3056236600000020
0.2544763499999974 0.3990167199999988 0.2568359899999990
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0.2564248999999990 0.4921970600000023 0.2638403699999969
0.1558160700000002 0.5376520900000017 0.2246461399999973
0.3479136099999991 0.5413657000000001 0.3398885100000015
0.4370981200000017 0.4769203399999995 0.3407199999999975
0.3622926700000022 0.4243049299999981 0.4642755200000011
0.6181937500000032 0.5728102400000026 0.4591382699999969
0.6552938199999971 0.7232905799999969 0.4621085899999997
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0.1618175899999983 0.5866076800000002 0.0872155400000025
0.0921000599999999 0.5864244099999993 0.2776888100000008
0.3643051499999999 0.5614079400000023 0.2500367700000012
0.3467679500000003 0.6002298399999972 0.4009325800000028
0.4610791500000033 0.4244629700000004 0.3932345200000000
0.4391885200000019 0.4595993200000024 0.2439428799999988
0.3308067399999999 0.3751456500000003 0.4240373900000023
0.4017510799999968 0.3900168999999991 0.5035928499999969
0.3015078900000034 0.4785535899999971 0.5387750100000019
0.3490948700000018 0.4924927400000030 0.5936859099999978
0.4819311500000012 0.5715878600000011 0.3009250400000028
0.4649597000000014 0.5788446399999998 0.4068136799999991
0.6535815700000001 0.6381983300000016 0.5800916600000008
0.6917568599999981 0.6179476699999995 0.4945487999999969
0.6282209700000010 0.6234450899999970 0.3275970999999984
0.5611786600000030 0.5690087300000002 0.5804025500000023
0.5389883400000031 0.5419803999999999 0.4764434399999971
0.5466167499999983 0.6288655600000013 0.4973433400000005
0.6069799599999968 0.8241941599999976 0.4774833199999975
0.6097990800000019 0.7792823799999979 0.5798412799999966
0.5756758500000032 0.7496160299999985 0.4917240699999965
0.6590944599999986 0.7499475500000017 0.3136888299999967
0.7032822700000025 0.7997390299999978 0.5224903800000007
0.6600450500000008 0.4151225999999966 0.3587861299999986
0.6877149199999977 0.3997722000000010 0.5103632200000021
0.5418197799999973 0.2868231200000011 0.4179576000000012
0.5754445999999973 0.3616358199999965 0.3055222500000028
0.5412660900000006 0.4139984899999973 0.5863237100000021
0.5613283799999991 0.2951845700000035 0.5917789599999992
0.6202696300000028 0.4320230800000004 0.6819350000000028
0.6407240699999974 0.3543721099999999 0.6801937999999979
0.6432192400000005 0.2671629499999995 0.3034856900000023
0.6281498000000028 0.2182871400000010 0.3889674099999993
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