iterations/neb0_image05_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
0.2141199900000004 0.5270113999999992 0.3236294100000023
0.2659477899999985 0.3963402299999998 0.2761269299999967
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0.3741816499999970 0.5594929800000017 0.2679222000000010
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0.3417931299999992 0.3714484999999996 0.4445268699999971
0.4130826100000036 0.3881870599999999 0.5215728599999991
0.3128102100000021 0.4760952199999977 0.5573028499999992
0.3604046100000033 0.4903704099999970 0.6119885299999979
0.4893921500000005 0.5678962900000002 0.3125250699999995
0.4576234199999973 0.5822252000000034 0.4006829300000021
0.6460603800000015 0.6421367000000018 0.5614182699999972
0.6855906999999988 0.6248172199999971 0.4774103100000033
0.6146466000000004 0.6247926799999988 0.3111747399999985
0.5591046699999964 0.5783690399999983 0.5784499700000012
0.5378565299999991 0.5373717599999992 0.4827701700000020
0.5377019399999980 0.6261782099999991 0.4876432699999995
0.5957478799999976 0.8261113200000025 0.4584264499999975
0.5986303199999981 0.7817273300000025 0.5607164199999985
0.5647167799999977 0.7516992199999990 0.4727928499999976
0.6475335599999994 0.7520473399999972 0.2937193899999997
0.6923355400000020 0.8036952100000008 0.5038570800000031
0.6486700999999968 0.4170963999999984 0.3400586300000015
0.6767693299999991 0.4007340699999986 0.4917726500000015
0.5303028900000015 0.2894669300000032 0.3997817099999992
0.5637806299999966 0.3643531700000011 0.2867129500000019
0.5296140000000022 0.4152083800000028 0.5689694799999998
0.5501395200000019 0.2967578200000034 0.5728364200000016
0.6084020199999998 0.4338442999999970 0.6637147699999986
0.6294008099999999 0.3568362500000006 0.6618210899999966
0.6310960499999965 0.2691638900000015 0.2836049799999998
0.6155454299999974 0.2195885300000029 0.3682515699999982
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