iterations/neb0_image05_iter14_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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0.5658859199999995 0.3738828799999965 0.2632058000000015
0.6206228799999991 0.3472537800000026 0.2895781599999978
0.6076148300000028 0.2794402899999966 0.4766855900000024
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0.6501232600000009 0.6145398700000015 0.2739850999999973
0.7120738699999976 0.5867943499999981 0.6514373099999986
0.7076408200000017 0.6632177999999982 0.6063270900000006
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