iterations/neb0_image03_iter11_CONTCAR output for 43: 3.6A-->1.6A 715(amd-3) Si-CH2H...H2HC-Si two dimer closed (TSS)
Status:
finished
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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0.4081803699999966 0.5924761099999998 0.4179396400000002
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0.6506203699999986 0.4857871999999972 0.4603579899999986
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0.5695964700000005 0.3641745500000013 0.2637546099999994
0.6243371400000015 0.3375525200000027 0.2901245700000032
0.6113139099999998 0.2697630799999970 0.4772117699999967
0.5059378099999989 0.4075298300000014 0.4187547699999996
0.5237553999999989 0.3961236099999965 0.5307982599999974
0.5081944200000024 0.3257078099999973 0.4656854600000031
0.5028487200000029 0.1795933100000013 0.2635404399999999
0.5029032300000011 0.2568597100000005 0.2048175400000005
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0.5910458700000021 0.1563657100000029 0.3838013800000013
0.5895663499999984 0.2023178700000017 0.1531302400000030
0.6726355799999979 0.4570629299999993 0.5410432500000013
0.6823165400000022 0.4854433799999995 0.3837074599999966
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0.6252107400000000 0.5415861299999989 0.6594516500000012
0.5614207599999972 0.6197752799999989 0.4160230000000027
0.6281778600000010 0.6894154200000031 0.4264212100000009
0.6058967999999965 0.5628167400000024 0.2686921100000035
0.6539137600000018 0.6048356900000016 0.2744507800000022
0.7157160699999991 0.5771881900000011 0.6519205299999982
0.7112873000000022 0.6533873099999994 0.6069342699999964
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