iterations/neb0_image01_iter61_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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0.6180111400000001 0.2566851200000002 0.3474821800000001
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0.2107479000000012 0.5801381500000033 0.3283649999999980
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0.3648581100000001 0.5618888899999988 0.2504841399999975
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0.3483607599999985 0.4927166499999984 0.5930865200000000
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0.4658104399999985 0.5786408800000018 0.4071304599999976
0.6540645700000027 0.6392645800000025 0.5803553399999970
0.6918435199999990 0.6192803400000031 0.4937721000000010
0.6283868399999974 0.6229372199999972 0.3280724000000035
0.5606291699999986 0.5694983400000027 0.5814559900000020
0.5390865199999979 0.5413539899999975 0.4777378799999994
0.5462568199999964 0.6283857800000021 0.4973196400000006
0.6066765200000006 0.8249692199999998 0.4771824099999975
0.6101581699999983 0.7797128599999965 0.5787682500000031
0.5753342399999966 0.7503683300000006 0.4919412799999989
0.6599633599999990 0.7499758100000022 0.3131561200000021
0.7029164400000028 0.8007491500000015 0.5236401299999969
0.6602845000000030 0.4156374299999968 0.3599121199999971
0.6878564000000011 0.3996666500000003 0.5114674900000011
0.5415257000000011 0.2881884700000015 0.4182739499999997
0.5753677900000014 0.3624700299999972 0.3055882299999979
0.5405936599999990 0.4120229299999991 0.5868818599999983
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0.6197903600000032 0.4322798899999967 0.6810899000000035
0.6406042799999980 0.3547739199999995 0.6807794200000004
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0.6271558299999995 0.2179296300000004 0.3871294200000008
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