iterations/neb0_image07_iter23_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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0.5620498400000002 0.3841380499999971 0.2628863300000006
0.6168491800000027 0.3574239499999976 0.2886206700000002
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0.5021312200000025 0.4201193899999964 0.4152074200000015
0.5168306099999995 0.4144289400000005 0.5295136700000000
0.5015006499999970 0.3409818399999978 0.4667251899999982
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0.5537258499999993 0.6396682999999967 0.4147948099999965
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0.5982730400000023 0.5828371500000031 0.2674934899999997
0.6462341900000013 0.6247611499999977 0.2734428699999967
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0.7037768400000033 0.6734275700000012 0.6059035500000007
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