iterations/neb0_image04_iter2_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
0.2102507600000010 0.5277475299999992 0.3182024999999982
0.2622163300000011 0.3975844899999998 0.2693417600000032
0.1320180399999984 0.4565450400000017 0.2194517399999967
0.6499460400000032 0.6380563900000027 0.4945029699999992
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0.2641916199999983 0.4907821199999987 0.2763520499999998
0.1635447900000031 0.5362727400000011 0.2372321599999978
0.3556351000000006 0.5399606599999984 0.3524184600000027
0.4448280399999973 0.4755283599999984 0.3532189299999970
0.3699954300000030 0.4228660500000032 0.4768534000000031
0.6104544000000018 0.5742155000000011 0.4465701900000028
0.6475786900000031 0.7246932400000006 0.4496354899999986
0.6407658600000019 0.4215986399999991 0.4429487499999993
0.5758727799999974 0.3202076700000021 0.3725562899999986
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0.2768153499999997 0.5239952700000003 0.1786119599999978
0.3041361000000009 0.5110496900000001 0.3473708200000019
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0.1281994799999993 0.5974400500000030 0.2640618499999974
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0.6432580399999992 0.7139605099999997 0.3391837499999966
0.6952241400000005 0.7660497199999980 0.4653117800000004
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0.6109241999999995 0.2575109900000001 0.3352951700000020
0.1986322699999974 0.4991547999999995 0.3767093299999971
0.2180647100000002 0.5785862199999983 0.3424045499999977
0.2512333199999972 0.5439823500000003 0.1478709800000004
0.2570607999999979 0.3746503400000023 0.3352296300000006
0.2939423300000001 0.3786118900000019 0.2425444100000007
0.2354405399999990 0.3804882000000021 0.2246293999999978
0.1054958200000016 0.4627059999999972 0.1694030000000026
0.1164851899999988 0.4387797500000019 0.2816223800000017
0.1544257999999985 0.4167461500000016 0.1958252200000032
0.1695707800000008 0.5851771700000015 0.0996880300000029
0.0998226099999968 0.5850629299999994 0.2901695400000008
0.3720336399999979 0.5599482200000026 0.2624845100000002
0.3545039500000016 0.5988451799999979 0.4135086100000009
0.4688399799999985 0.4230992199999974 0.4058370300000007
0.4469298699999982 0.4582023899999967 0.2564030699999975
0.3385102299999971 0.3736967099999973 0.4365943299999984
0.4094628599999979 0.3886317500000018 0.5161700399999987
0.3092592799999991 0.4771597399999976 0.5513258100000016
0.3569061099999971 0.4910640800000010 0.6062914999999975
0.4896603899999974 0.5701766099999972 0.3133462400000013
0.4726164799999992 0.5773865800000024 0.4193650200000008
0.6458063800000033 0.6395968300000021 0.5675788699999984
0.6840065900000027 0.6192320400000000 0.4820430799999968
0.6204871500000024 0.6248576699999973 0.3151188900000008
0.5535345199999995 0.5703859600000030 0.5677435300000013
0.5312767799999989 0.5434145999999984 0.4638229600000017
0.5389328999999989 0.6303349000000011 0.4847797600000021
0.5992575000000002 0.8255829300000030 0.4649784499999967
0.6020681600000017 0.7806687900000000 0.5672812500000006
0.5679415800000029 0.7509766000000013 0.4791498299999972
0.6513096400000009 0.7513358499999967 0.3012305499999997
0.6955538099999998 0.8011000799999977 0.5099280700000008
0.6523119699999995 0.4165330000000012 0.3462169299999971
0.6799431099999964 0.4012132599999987 0.4977324500000009
0.5341037700000015 0.2881718300000031 0.4054464399999986
0.5677170399999980 0.3630568999999966 0.2929787500000032
0.5335871600000033 0.4155017499999971 0.5737490200000011
0.5535536000000008 0.2967095500000028 0.5792752300000004
0.6125557000000015 0.4334526199999971 0.6694815600000013
0.6329835499999987 0.3557525200000029 0.6676085499999971
0.6355439900000022 0.2685605400000028 0.2910476899999992
0.6204802399999991 0.2197329700000026 0.3765458700000011
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