iterations/neb0_image01_iter28_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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0.4044669399999989 0.6020150900000019 0.4173787799999999
0.2249228000000016 0.5104697000000016 0.5552919699999990
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0.2209253099999984 0.3617630600000012 0.5227569500000016
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0.5767416300000008 0.2337240800000018 0.2923466599999998
0.6543094199999970 0.4762477599999997 0.4608491299999997
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0.2191916700000007 0.5561429799999971 0.6333156999999972
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0.1936538200000015 0.3848987200000025 0.3751615400000006
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0.0991496500000011 0.4698531000000017 0.6217769599999983
0.5732867500000012 0.3545576799999992 0.2642814000000016
0.6280339999999995 0.3279077799999968 0.2906412999999972
0.6150086600000009 0.2601464700000022 0.4777155000000022
0.5095135500000012 0.3981181400000011 0.4192765199999968
0.5274156799999972 0.3865165200000007 0.5313487900000027
0.5118556799999965 0.3161999599999987 0.4661022700000004
0.5065656399999980 0.1699191599999992 0.2641336200000026
0.5065604099999987 0.2471904499999980 0.2054120499999996
0.4954252499999967 0.2459130700000003 0.3215444100000013
0.5948129699999996 0.1467465300000015 0.3842861700000029
0.5932813699999997 0.1927245799999966 0.1537141800000015
0.6763329899999988 0.4474364900000012 0.5415173000000024
0.6860021700000019 0.4758004999999983 0.3841715100000016
0.6177612400000001 0.6469875900000019 0.6048611200000025
0.6289060399999968 0.5318418199999968 0.6599596599999984
0.5650885399999979 0.6101877999999985 0.4166163800000007
0.6318806000000023 0.6797128500000014 0.4268656899999996
0.6094640800000022 0.5532500999999996 0.2691827499999988
0.6576141600000014 0.5951700500000001 0.2750752999999975
0.7194438200000022 0.5675288999999992 0.6524937300000033
0.7150227899999990 0.6437524400000001 0.6076046599999998
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