iterations/neb0_image01_iter46_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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0.1559539000000001 0.5375616700000023 0.2245023899999978
0.3481160799999969 0.5415026399999974 0.3396648900000017
0.4374569000000008 0.4767386400000007 0.3410890099999975
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0.3012858499999993 0.4776795800000002 0.5378680800000026
0.3486331699999994 0.4927773699999989 0.5933743599999985
0.4824693300000007 0.5714226699999969 0.3006322700000013
0.4655603900000003 0.5786530000000027 0.4066881700000025
0.6539151400000023 0.6388365999999976 0.5802354699999981
0.6918460099999990 0.6192235099999976 0.4938823700000015
0.6282406699999967 0.6230334799999966 0.3277535599999979
0.5604975500000009 0.5694450499999988 0.5812577299999973
0.5389194400000008 0.5415849399999999 0.4775859100000019
0.5462269000000006 0.6284099800000007 0.4975120100000012
0.6067970300000027 0.8247815300000028 0.4773515500000016
0.6099899100000030 0.7796741000000011 0.5793292500000007
0.5753126199999983 0.7501872100000000 0.4920736799999972
0.6597163200000011 0.7500228099999973 0.3132606100000004
0.7030169599999994 0.8003622199999967 0.5230467299999972
0.6601597200000029 0.4154566099999997 0.3595920899999996
0.6879191599999999 0.3996635199999972 0.5112518999999978
0.5416390299999989 0.2878452699999983 0.4180040999999974
0.5753557399999991 0.3621132000000031 0.3053918299999978
0.5407428600000017 0.4125487100000029 0.5867512299999973
0.5618924899999982 0.2941912100000010 0.5913712999999987
0.6199088999999987 0.4324034300000008 0.6811740899999990
0.6405925199999984 0.3547200300000029 0.6806079999999994
0.6423976800000020 0.2672100799999981 0.3026372200000012
0.6274648899999988 0.2177348700000010 0.3877889999999979
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