iterations/neb0_image06_iter2_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
0.2154089300000024 0.5267997300000005 0.3265563300000025
0.2673747600000027 0.3966364400000018 0.2776959400000010
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0.1687030599999986 0.5353242099999989 0.2455860900000033
0.3607941300000022 0.5390115200000025 0.3607728300000019
0.4499818999999974 0.4745806099999967 0.3615675599999975
0.3751527499999980 0.4219200900000004 0.4852095500000004
0.6052964699999990 0.5751643199999990 0.4382203799999971
0.6424203999999989 0.7256410399999993 0.4412813699999987
0.6356065299999969 0.4225449600000033 0.4345915999999974
0.5707165600000010 0.3211505399999979 0.3641997399999966
0.5656129699999966 0.3670584999999988 0.5592212299999986
0.2819737000000018 0.5230475099999978 0.1869659199999987
0.3092943700000035 0.5101022099999994 0.3557244300000022
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0.2232230299999998 0.5776382299999980 0.3507585600000027
0.2563916800000001 0.5430343700000009 0.1562250200000008
0.2622191399999991 0.3737024599999970 0.3435837299999989
0.2991006700000014 0.3776640199999974 0.2508984899999973
0.2405987900000000 0.3795402499999980 0.2329834199999965
0.1106540800000033 0.4617580700000019 0.1777570200000014
0.1216434899999967 0.4378318400000012 0.2899763699999980
0.1595841099999973 0.4157982500000017 0.2041792400000020
0.1747290599999971 0.5842292199999974 0.1080420700000033
0.1049808900000002 0.5841149800000025 0.2985235900000021
0.3771918400000018 0.5590004700000009 0.2708385199999981
0.3596622199999970 0.5978974100000016 0.4218626600000022
0.4739986200000033 0.4221520999999981 0.4141911600000014
0.4520886199999978 0.4572541300000026 0.2647573300000019
0.3436685400000030 0.3727485799999997 0.4449483100000009
0.4146213399999965 0.3876836600000004 0.5245239099999992
0.3144177699999986 0.4762117900000007 0.5596797099999975
0.3620643400000034 0.4901160800000000 0.6146451600000020
0.4948187500000003 0.5692296300000024 0.3216994499999970
0.4777660900000029 0.5764404700000014 0.4277066300000030
0.6406479600000026 0.6405447100000004 0.5592247200000031
0.6788484300000022 0.6201801500000030 0.4736890799999998
0.6153289900000019 0.6258059700000018 0.3067647700000009
0.5483776599999999 0.5713352200000017 0.5593911400000025
0.5261313399999992 0.5443614599999975 0.4554805200000018
0.5337752699999996 0.6312838099999993 0.4764264599999990
0.5940991300000036 0.8265308300000029 0.4566244800000021
0.5969098400000021 0.7816167200000024 0.5589273100000014
0.5627832699999971 0.7519246000000024 0.4707958999999988
0.6461513499999967 0.7522838300000032 0.2928765400000017
0.6903954799999994 0.8020480400000025 0.5015740799999975
0.6471537299999994 0.4174811199999979 0.3378633399999984
0.6747848899999980 0.4021614899999975 0.4893791000000007
0.5289453800000032 0.2891201500000022 0.3970930999999993
0.5625586900000030 0.3640053700000010 0.2846250400000017
0.5284296100000034 0.4164494500000018 0.5653974100000028
0.5483955899999984 0.2976577700000007 0.5709229799999989
0.6073972499999982 0.4344012600000013 0.6611288900000005
0.6278256100000021 0.3566999000000024 0.6592556299999970
0.6303854299999969 0.2695085200000022 0.2826942900000020
0.6153218099999975 0.2206812299999967 0.3681914699999993
0.00000000E+00 0.00000000E+00 0.00000000E+00
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