iterations/neb0_image02_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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0.1581549799999991 0.5369572299999987 0.2289143400000029
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0.4393777399999976 0.4747650500000020 0.3425504499999974
0.3660721199999983 0.4243996000000010 0.4697006500000001
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0.6522515799999979 0.7243352799999982 0.4574800800000034
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0.5823202300000005 0.3194619000000003 0.3806967000000014
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0.2709241299999974 0.5209067899999980 0.1687924499999980
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0.1104784199999997 0.4400890100000012 0.2736655900000002
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0.4633059399999979 0.4228937399999992 0.3948529700000023
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0.3040623699999969 0.4766748300000003 0.5415044200000025
0.3503511199999991 0.4929381199999980 0.5973951699999986
0.4855549600000018 0.5698166299999983 0.3045987499999967
0.4659465800000007 0.5786093899999969 0.4062607500000013
0.6517981800000001 0.6388156499999980 0.5748856000000018
0.6899829800000035 0.6211871900000006 0.4887402199999968
0.6247457099999991 0.6231463100000028 0.3235235799999998
0.5578526299999993 0.5715683000000027 0.5821389600000018
0.5391850700000020 0.5405598899999973 0.4772556400000028
0.5439507999999975 0.6280492400000028 0.4946468300000006
0.6041714600000034 0.8254151499999978 0.4726261100000002
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0.5727479099999968 0.7514229800000010 0.4883391199999991
0.6567621499999987 0.7500611500000005 0.3084185900000023
0.7002979299999978 0.8008043299999983 0.5171050300000033
0.6573886799999968 0.4160184799999982 0.3544858300000016
0.6858200799999992 0.4010522100000031 0.5076056300000005
0.5395446300000017 0.2900774000000013 0.4138081899999975
0.5731848799999995 0.3634249600000032 0.3012708700000033
0.5378967199999991 0.4118979899999999 0.5849163700000020
0.5601020699999992 0.2932765700000033 0.5883476400000021
0.6164368100000033 0.4323130399999968 0.6770646800000009
0.6377501300000006 0.3559872299999967 0.6772679299999993
0.6392413000000019 0.2673426200000009 0.2966018899999980
0.6238267600000000 0.2170739700000013 0.3809305999999992
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