iterations/neb0_image03_iter7_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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0.6243408300000013 0.3375438599999967 0.2901203199999998
0.6113132799999974 0.2697629999999975 0.4772251199999999
0.5059012199999984 0.4075834699999987 0.4187664000000026
0.5237618299999980 0.3961317400000013 0.5308145600000032
0.5081957800000012 0.3257369100000034 0.4656947300000027
0.5028352300000023 0.1795975799999994 0.2635201000000009
0.5029191799999992 0.2568709800000022 0.2048012799999981
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0.5910218900000004 0.1563475399999987 0.3838153299999973
0.5895724599999994 0.2023069800000030 0.1531759599999987
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0.6059176199999996 0.5627449500000026 0.2687305400000000
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0.7112730600000035 0.6533356999999995 0.6069337599999969
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