iterations/neb0_image08_iter6_CONTCAR output for 43: 3.6A-->1.6A 715(amd-3) Si-CH2H...H2HC-Si two dimer closed (TSS)
Status:
finished
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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0.2066601499999976 0.3508666500000004 0.3771262599999972
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0.1120965400000031 0.4358828599999995 0.6235759400000020
0.5602943700000012 0.3885005699999979 0.2623435799999996
0.6150433899999967 0.3618826399999975 0.2887537900000012
0.6020262700000032 0.2940685000000016 0.4759007700000026
0.4985171499999979 0.4283017099999995 0.4174018399999966
0.5146384299999980 0.4200582100000005 0.5288217200000034
0.4989736300000018 0.3492055500000006 0.4645857900000010
0.4935285500000006 0.2039373599999976 0.2621643299999974
0.4936198799999971 0.2811984000000010 0.2034223400000030
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0.5817198200000036 0.1806574100000020 0.3824663400000006
0.5802735199999987 0.2266315500000005 0.1518328000000011
0.6633276499999994 0.4813732599999980 0.5396849600000024
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0.6047630799999979 0.6810240599999986 0.6031205099999966
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0.5521506299999999 0.6440006699999969 0.4146996099999996
0.6188556399999996 0.7137238500000009 0.4251917699999979
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0.7063927900000024 0.6015475700000010 0.6505483700000028
0.7019789000000003 0.6776701699999990 0.6055684199999973
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