iterations/neb0_image06_iter24_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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0.3773679800000025 0.5589894299999969 0.2712661600000033
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0.4743313700000016 0.5768198700000013 0.4237902300000016
0.6404877399999975 0.6405495099999996 0.5587047900000002
0.6791104099999998 0.6205538299999986 0.4733846800000023
0.6149925499999966 0.6256898199999981 0.3065106199999974
0.5492612999999977 0.5722531600000025 0.5623928400000011
0.5296076099999993 0.5430544199999972 0.4585507899999968
0.5342168099999967 0.6309623699999989 0.4770673000000016
0.5938746400000028 0.8265713300000002 0.4562326100000007
0.5966958099999999 0.7816813199999970 0.5585556799999978
0.5625445399999975 0.7520442000000003 0.4704843299999979
0.6459523999999988 0.7523064599999998 0.2924454999999995
0.6901676399999985 0.8021572600000013 0.5012414400000011
0.6469233999999986 0.4175773400000011 0.3375319200000035
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0.5287825200000000 0.2892380500000016 0.3968010600000014
0.5623592399999993 0.3640542400000015 0.2844274200000001
0.5281841400000005 0.4165142499999988 0.5655542599999990
0.5481905600000019 0.2976224599999995 0.5706975800000009
0.6071246899999991 0.4344382199999970 0.6608729699999998
0.6276490699999968 0.3567078199999969 0.6590375800000032
0.6301324599999987 0.2695614200000023 0.2822443399999983
0.6150465699999970 0.2206353199999995 0.3676779400000001
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