iterations/neb0_image02_iter18_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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0.2570535999999990 0.3985884200000029 0.2610467499999984
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0.6509946600000021 0.6386450899999971 0.5758747499999970
0.6891916699999996 0.6184083599999965 0.4903495100000015
0.6256228900000025 0.6238960399999982 0.3234476299999969
0.5586347200000006 0.5695206199999987 0.5763545399999970
0.5365615899999980 0.5424074499999989 0.4723448599999998
0.5440813900000023 0.6293432399999972 0.4931907499999966
0.6044009399999979 0.8246573099999992 0.4732856899999973
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0.5587557300000014 0.2956362400000003 0.5876783599999982
0.6176823699999971 0.4324931900000024 0.6778023299999987
0.6381586799999965 0.3548438099999984 0.6760509100000007
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0.6255555700000031 0.2187488599999980 0.3847573700000027
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