iterations/neb0_image08_iter17_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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0.3664717300000007 0.5381269399999979 0.3698456999999991
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0.4797035499999964 0.4226296900000008 0.4224166500000024
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0.4203946299999970 0.3866890999999981 0.5335631299999974
0.3201218900000029 0.4751763000000011 0.5688981099999992
0.3677487699999986 0.4891091100000011 0.6239788299999987
0.4982267800000031 0.5671250600000022 0.3304722000000027
0.4736310700000033 0.5765910499999976 0.4249690199999989
0.6349158000000017 0.6414780200000010 0.5494975100000019
0.6738318299999975 0.6216733500000018 0.4644179200000025
0.6093205499999996 0.6265344799999966 0.2977325900000025
0.5446541199999970 0.5736791499999967 0.5578204799999966
0.5315987800000030 0.5423650400000000 0.4557462400000034
0.5297314499999999 0.6310537100000033 0.4689988100000022
0.5883526000000003 0.8275847499999998 0.4472672500000030
0.5911582199999970 0.7826944500000010 0.5496165599999969
0.5570390800000027 0.7530688499999982 0.4615197099999975
0.6403970799999996 0.7532978600000035 0.2835143100000010
0.6846629699999980 0.8031736399999971 0.4922486500000005
0.6413925100000029 0.4186203800000001 0.3286085399999976
0.6690900099999979 0.4033576300000021 0.4801846800000007
0.5232737600000021 0.2902836299999976 0.3878491800000035
0.5568135400000003 0.3650188000000014 0.2756746700000008
0.5228236499999994 0.4175312899999994 0.5571560099999999
0.5426400599999965 0.2986012499999973 0.5617567299999990
0.6016158300000001 0.4353202799999991 0.6519059600000006
0.6221414600000017 0.3577863000000008 0.6501342199999982
0.6246194599999981 0.2706255599999992 0.2732857999999965
0.6095073299999996 0.2216477099999992 0.3587819899999971
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