iterations/neb0_image01_iter54_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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0.3624000499999980 0.4243195199999974 0.4642026599999980
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0.3013491500000001 0.4780439900000033 0.5382470899999987
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0.4821643200000025 0.5714355599999976 0.3010610299999996
0.4653798200000026 0.5787975200000020 0.4068769499999974
0.6538096399999986 0.6386286700000028 0.5801883099999969
0.6918057600000012 0.6186993800000025 0.4941794000000002
0.6282624099999978 0.6232345499999994 0.3277012599999978
0.5607993899999997 0.5692717000000016 0.5809674500000028
0.5389706699999977 0.5417187400000003 0.4771073799999996
0.5463862900000009 0.6286096899999976 0.4974065700000025
0.6068518100000020 0.8245261599999978 0.4773741899999990
0.6099257799999975 0.7795081299999964 0.5794691899999975
0.5755060199999988 0.7499905299999980 0.4919051800000034
0.6594956100000005 0.7500116599999984 0.3133877200000015
0.7031230999999991 0.8001969099999968 0.5229444200000017
0.6601248600000034 0.4153340399999976 0.3592933999999985
0.6878288600000033 0.3997021599999968 0.5109308500000012
0.5416784199999967 0.2874532499999987 0.4180380000000028
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0.5616960600000027 0.2945580199999966 0.5915494400000014
0.6200443800000031 0.4321424199999981 0.6814733599999983
0.6406648399999995 0.3545900200000034 0.6804819999999978
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0.6276849400000017 0.2180647100000002 0.3881262000000021
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