iterations/neb0_image04_iter56_CONTCAR output for 3: !!! 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
terminated
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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0.4628374300000004 0.5797830699999977 0.4072371000000032
0.6468649199999987 0.6406154200000032 0.5662243000000018
0.6864528500000020 0.6224363400000001 0.4814647700000023
0.6186165499999987 0.6239333199999990 0.3148325599999993
0.5575963400000035 0.5747135800000009 0.5772919899999991
0.5377813899999992 0.5390613300000027 0.4757606699999997
0.5399535199999974 0.6280263200000036 0.4881810099999981
0.5985670600000006 0.8260145499999965 0.4632099399999987
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0.6116926899999982 0.4338175399999997 0.6678348499999984
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0.6188943699999996 0.2194433599999996 0.3734732100000002
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