iterations/neb0_image08_iter10_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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0.5601824499999992 0.3888085299999986 0.2622749200000030
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0.6019472400000012 0.2943045900000030 0.4759282500000026
0.5005506299999993 0.4246098799999984 0.4170697500000031
0.5147569599999997 0.4198577399999976 0.5282573100000008
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0.5519813200000030 0.6443079499999982 0.4145956899999987
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0.6445518399999983 0.6294722499999992 0.2730306300000009
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0.7018497800000034 0.6779511100000022 0.6055917099999988
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