iterations/neb0_image01_iter8_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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0.2544789800000018 0.3990478799999977 0.2568168299999982
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0.1558107199999981 0.5376639300000008 0.2246133000000015
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0.4371066100000007 0.4769056800000016 0.3407075000000006
0.3622916300000014 0.4242714700000008 0.4642907100000002
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0.6553438600000021 0.7232887300000002 0.4621374299999985
0.6485217199999980 0.4202046300000006 0.4555240999999981
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0.2435101800000012 0.5454303599999974 0.1352721299999970
0.2493260999999976 0.3760243299999999 0.3226239999999976
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0.2277091699999971 0.3819228199999998 0.2121620400000026
0.0977522900000025 0.4641690899999986 0.1568632299999990
0.1087348000000006 0.4402245400000027 0.2691195700000009
0.1466808400000019 0.4181617400000022 0.1833078900000018
0.1618266999999989 0.5865960599999980 0.0872106599999967
0.0920892099999975 0.5864550699999995 0.2776730499999971
0.3642827700000026 0.5613656700000007 0.2500910999999988
0.3467714800000010 0.6001959199999973 0.4009034299999996
0.4610741500000017 0.4245271500000030 0.3932312900000028
0.4391890200000006 0.4596177000000026 0.2439525300000014
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0.4017359799999980 0.3900334000000001 0.5036127799999974
0.3015191100000010 0.4785807499999990 0.5388090800000001
0.3491168199999990 0.4924917800000017 0.5937138999999974
0.4819188199999971 0.5716006500000006 0.3009323100000003
0.4649353599999984 0.5788329199999964 0.4067649400000022
0.6535681299999965 0.6381827399999978 0.5801021999999989
0.6917460100000028 0.6178991999999965 0.4945742999999965
0.6282216099999971 0.6234485100000029 0.3276102499999993
0.5612155700000017 0.5689938299999966 0.5803287800000021
0.5390013700000011 0.5420004100000000 0.4764036799999971
0.5466427499999966 0.6288703900000030 0.4973300899999984
0.6069843000000006 0.8241771599999979 0.4774856100000022
0.6097971800000010 0.7792649200000028 0.5798573599999983
0.5756758899999994 0.7495858699999971 0.4917008099999975
0.6590723500000024 0.7499378300000004 0.3137131299999965
0.7032900700000013 0.7996907599999972 0.5224435200000030
0.6600476200000003 0.4151144900000006 0.3587451000000001
0.6877095700000027 0.3997766499999997 0.5103327799999988
0.5418459799999980 0.2868027600000005 0.4179461599999996
0.5754486200000031 0.3616369200000022 0.3055032099999977
0.5412827600000014 0.4140524499999998 0.5863080199999970
0.5613051600000034 0.2952055900000019 0.5918002399999978
0.6202846899999983 0.4320448699999986 0.6819771400000008
0.6407352000000017 0.3543451899999965 0.6801798300000002
0.6432503199999999 0.2671548200000018 0.3035200400000022
0.6281789000000018 0.2182960800000018 0.3890267299999977
0.00000000E+00 0.00000000E+00 0.00000000E+00
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