iterations/neb0_image08_iter30_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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0.2735100800000012 0.3954467399999970 0.2877512499999995
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0.4674299200000007 0.5784589100000019 0.4223389900000001
0.6353485300000017 0.6416515700000005 0.5485752499999990
0.6768364300000016 0.6234905299999980 0.4647245700000013
0.6081977300000005 0.6262395700000027 0.2974224399999983
0.5483841200000015 0.5778943400000003 0.5633508399999982
0.5316916399999982 0.5394550299999992 0.4582565999999986
0.5304126300000007 0.6296028599999985 0.4714486900000026
0.5880267699999990 0.8275081900000032 0.4465675100000013
0.5908129700000018 0.7827669799999981 0.5488605399999997
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0.6399479399999990 0.7533488400000010 0.2825415000000007
0.6843456300000028 0.8037801999999985 0.4918178599999976
0.6410296900000034 0.4184648399999986 0.3277005099999997
0.6689215099999970 0.4030168999999972 0.4797272799999988
0.5228040800000002 0.2901525999999990 0.3873196899999982
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0.5226554300000004 0.4175076799999999 0.5573587800000013
0.5422521799999984 0.2985436499999992 0.5610633699999994
0.6011607399999974 0.4354908099999975 0.6513730899999999
0.6220085100000006 0.3576725599999975 0.6497370299999972
0.6241474099999991 0.2705550100000025 0.2726303999999971
0.6090962099999970 0.2215687200000005 0.3577765699999986
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