iterations/neb0_image02_iter41_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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0.4393801499999981 0.4427253799999988 0.2409420099999977
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0.3039078400000008 0.4667055500000004 0.5314252200000027
0.3407397699999990 0.4994882700000005 0.5938469900000030
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0.4554938300000018 0.5804241599999997 0.3728499200000002
0.6576111299999994 0.6400330399999987 0.5676445499999971
0.6956365500000032 0.6412871799999991 0.4772910399999972
0.6184699499999979 0.6177958099999969 0.3239393100000001
0.5521088300000017 0.5862862399999997 0.6239279400000015
0.5581881100000032 0.5273561300000011 0.5124714499999996
0.5429638499999996 0.6188208599999996 0.5050889199999986
0.6024593599999974 0.8308949999999982 0.4677050499999993
0.6039249800000022 0.7916932400000007 0.5817835200000019
0.5703080799999967 0.7610583000000020 0.4940975000000023
0.6588034600000015 0.7478343000000010 0.3002845299999990
0.6974498499999982 0.8051802800000019 0.5087550000000007
0.6568615199999996 0.4190192100000019 0.3539511399999995
0.6907502199999982 0.4065186899999986 0.5180026299999980
0.5414516100000029 0.3097691600000019 0.4138273699999999
0.5753425799999974 0.3725165600000011 0.3008381100000008
0.5320862800000015 0.3934438200000017 0.6042647900000020
0.5697772099999980 0.2761870300000027 0.5932561699999965
0.6072919100000007 0.4292435600000033 0.6710827200000011
0.6336170599999988 0.3655829799999992 0.6854670000000027
0.6292196599999968 0.2654209600000002 0.2771277299999966
0.6114925700000029 0.2045053000000010 0.3541892300000029
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