iterations/neb0_image09_iter42_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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0.3896311399999988 0.4086346899999995 0.5328115200000028
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0.3373204099999967 0.4730171599999977 0.6053259999999980
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0.4079067799999976 0.5505688399999968 0.2624027399999989
0.1701873299999974 0.6333148300000033 0.1055273400000019
0.6413601200000016 0.6495940300000029 0.5046075500000029
0.7282173600000021 0.6732528499999972 0.4588550699999985
0.5708484600000006 0.6178218299999969 0.2835137799999998
0.6366943299999974 0.6680633300000025 0.7779114100000015
0.7620178600000003 0.4520521999999971 0.7179117499999990
0.5664098399999986 0.5606705100000013 0.5358092199999973
0.5705654400000029 0.8279368600000012 0.4142883199999972
0.5731044999999995 0.7854940200000016 0.5178456599999990
0.5386190999999982 0.7558452199999977 0.4295091899999974
0.6200156199999967 0.7573004600000033 0.2424296800000008
0.6679713199999995 0.8215528599999971 0.4677218300000021
0.6227642500000030 0.4173369100000031 0.2926432699999992
0.6553867900000014 0.3987361200000024 0.4518963700000000
0.5049071400000003 0.2918452899999977 0.3577725199999975
0.5376610200000016 0.3691940200000019 0.2485607200000004
0.5135635600000015 0.4205491800000019 0.5688059200000026
0.5241935199999972 0.2980244499999998 0.5326389299999974
0.5831798500000005 0.4346701300000007 0.6257321300000029
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0.6046690200000029 0.2732555600000026 0.2399158500000027
0.5891186200000007 0.2219760199999996 0.3219670100000016
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