iterations/neb0_image05_iter4_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
0.2128396499999994 0.5272801500000028 0.3224074600000009
0.2648027799999966 0.3971196099999972 0.2735342000000003
0.1346090199999992 0.4560668900000024 0.2236552000000032
0.6473583499999975 0.6385180199999994 0.4902584200000035
0.5509342799999999 0.5807876200000024 0.4917895199999975
0.5974188499999968 0.7756346199999982 0.4901485199999982
0.2667710899999989 0.4903061400000013 0.2805573600000031
0.1661426000000006 0.5357918500000025 0.2414115899999985
0.3582217000000014 0.5394935799999985 0.3566303599999969
0.4473103199999997 0.4750610399999999 0.3572614300000012
0.3725715500000035 0.4224052699999987 0.4811068899999995
0.6079016500000023 0.5746910900000017 0.4425163699999999
0.6450041200000030 0.7251928199999966 0.4454652900000013
0.6381541299999967 0.4220405599999992 0.4387434699999986
0.5732922999999985 0.3206393700000021 0.3683839600000027
0.5681526400000010 0.3665894800000018 0.5632854899999984
0.2793982099999965 0.5234864399999992 0.1828117800000015
0.3067472899999970 0.5105855700000035 0.3515674300000029
0.1906302900000014 0.5616038799999998 0.1471224100000015
0.1307920799999991 0.5969306399999965 0.2682803800000002
0.6055485300000001 0.5829590000000024 0.3327028400000032
0.6275367900000006 0.4999965200000034 0.4666367100000031
0.6406602899999996 0.7144204000000016 0.3349621300000010
0.6926196100000013 0.7665213399999971 0.4611002600000020
0.3929997799999967 0.4765867099999994 0.3982394900000017
0.3434817799999976 0.4602165700000000 0.5664578399999982
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0.5928535099999976 0.3699071599999968 0.4569149699999997
0.6033923600000008 0.3853480599999983 0.6503375899999995
0.6083123700000002 0.2579822699999994 0.3310916000000006
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0.2206657899999982 0.5781087900000017 0.3465890700000003
0.2538342200000017 0.5435061599999997 0.1520590100000021
0.2596551199999979 0.3741642299999981 0.3394116099999991
0.2965352800000005 0.3781190999999993 0.2467565199999981
0.2380362600000012 0.3800143200000008 0.2288425300000014
0.1080898200000036 0.4622375300000030 0.1736005200000008
0.1190762299999975 0.4383051300000034 0.2858292299999974
0.1570196799999977 0.4162656800000022 0.2000250099999974
0.1721634600000002 0.5846974600000010 0.1039014400000013
0.1024223699999993 0.5845802300000003 0.2943721700000026
0.3746228400000007 0.5594709699999996 0.2667200699999981
0.3570986300000030 0.5983499100000031 0.4176870000000008
0.4714432800000026 0.4226537899999983 0.4100280899999973
0.4495309400000025 0.4577112899999989 0.2606320499999981
0.3411087699999982 0.3732242399999990 0.4407881899999992
0.4120613899999981 0.3881500299999985 0.5203561900000011
0.3118547600000028 0.4766844800000030 0.5555254699999992
0.3594866500000009 0.4905811799999995 0.6104684199999966
0.4922584199999989 0.5697178300000019 0.3175710599999988
0.4750305100000034 0.5769476999999981 0.4232204199999998
0.6432163300000013 0.6400707700000012 0.5633760600000031
0.6814135899999982 0.6197298399999980 0.4778418000000002
0.6179010299999987 0.6253572099999971 0.3109022499999980
0.5509762000000009 0.5709089799999987 0.5636089899999988
0.5290015900000000 0.5438764700000007 0.4599029399999992
0.5363631499999997 0.6308443699999984 0.4806083699999988
0.5966621900000035 0.8260565000000000 0.4607725600000023
0.5994740399999969 0.7811473000000007 0.5630917000000011
0.5653446199999976 0.7514607499999997 0.4749518699999982
0.6487200500000014 0.7518181499999983 0.2970162599999995
0.6929615999999967 0.8015767999999994 0.5057235499999990
0.6497209400000017 0.4170181499999970 0.3420113199999975
0.6773580999999993 0.4016974700000020 0.4935481899999985
0.5315172899999965 0.2886609299999989 0.4012345699999997
0.5651210799999973 0.3635393100000002 0.2887707399999968
0.5309953300000032 0.4159718200000029 0.5695837199999971
0.5509655800000033 0.2971677099999965 0.5750845399999989
0.6099608899999964 0.4339276400000003 0.6652789999999982
0.6303995999999970 0.3562272200000010 0.6634272800000005
0.6329470599999993 0.2690407699999966 0.2868344600000015
0.6178747700000002 0.2202171899999996 0.3723244899999969
0.00000000E+00 0.00000000E+00 0.00000000E+00
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