iterations/neb0_image03_iter27_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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0.6243403699999988 0.3375715999999969 0.2901222699999977
0.6113305699999998 0.2697534899999994 0.4772210699999988
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0.7112966299999997 0.6534202400000027 0.6070496299999988
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