iterations/neb0_image04_iter3_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
0.2102529699999991 0.5277513099999993 0.3182137800000007
0.2622164799999993 0.3975962000000024 0.2693463900000026
0.1320205600000008 0.4565491099999974 0.2194680300000016
0.6499435099999999 0.6380433100000005 0.4944778799999980
0.5534036800000024 0.5803256900000022 0.4957578900000001
0.6000013499999994 0.7751644900000016 0.4943332900000001
0.2641860900000026 0.4907772099999974 0.2763703899999967
0.1635521700000027 0.5362768099999968 0.2372250399999984
0.3556385500000019 0.5399884600000036 0.3524378799999965
0.4447818200000029 0.4755311199999994 0.3531649700000017
0.3699986700000011 0.4228632900000022 0.4768785699999967
0.6104729199999994 0.5742111599999973 0.4466144100000022
0.6475945999999979 0.7247100399999979 0.4496422699999982
0.6407585799999964 0.4215814000000009 0.4429560700000010
0.5758621499999990 0.3201978600000004 0.3725579899999971
0.5707663900000028 0.3661190099999985 0.5675781200000003
0.2768048900000011 0.5239656099999976 0.1786074600000020
0.3041498400000009 0.5110522299999971 0.3473696399999966
0.1880531099999985 0.5620708800000003 0.1429260600000006
0.1282053799999971 0.5974149800000035 0.2640914500000022
0.6081553300000024 0.5824851699999982 0.3368954900000034
0.6301375399999998 0.4994985000000014 0.4708372300000008
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0.6951974699999965 0.7660486999999989 0.4652970300000021
0.3904009800000026 0.4770599499999975 0.3940574100000021
0.3408895399999992 0.4606956599999990 0.5622686800000025
0.4666924699999981 0.5551800100000008 0.3592791900000023
0.5954272399999994 0.3694155600000002 0.4610618999999971
0.6059659800000006 0.3848682200000013 0.6545221599999991
0.6109177299999971 0.2575019599999990 0.3352870200000027
0.1986412899999976 0.4991546299999996 0.3766999899999988
0.2180761899999979 0.5785851799999975 0.3424016800000018
0.2512436199999968 0.5439821100000017 0.1478710599999999
0.2570663300000007 0.3746414399999978 0.3352236699999978
0.2939466799999977 0.3785974899999971 0.2425631500000023
0.2354494000000003 0.3804895000000030 0.2246504599999994
0.1055016500000008 0.4627117599999977 0.1694095499999975
0.1164882300000016 0.4387803099999985 0.2816375800000017
0.1544314900000003 0.4167418700000027 0.1958346600000027
0.1695765400000013 0.5851738599999976 0.0997092899999998
0.0998330500000009 0.5850578900000016 0.2901803199999975
0.3720361299999979 0.5599451900000005 0.2625239199999996
0.3545107999999999 0.5988277599999989 0.4135001000000003
0.4688495799999970 0.4231119499999991 0.4058383100000000
0.4469372100000015 0.4581950299999988 0.2564347400000031
0.3385193100000023 0.3737004299999995 0.4366008000000008
0.4094711300000000 0.3886274999999983 0.5161700600000003
0.3092645899999980 0.4771595799999986 0.5513361000000003
0.3569005000000018 0.4910582199999993 0.6062847500000004
0.4896700899999971 0.5701828899999981 0.3133823200000023
0.4725661100000025 0.5774029299999981 0.4192390300000000
0.6458044500000000 0.6395977099999968 0.5675699000000023
0.6839991299999966 0.6192493100000007 0.4820345099999983
0.6204861800000003 0.6248749000000018 0.3150965999999968
0.5535394899999986 0.5704115799999983 0.5677572999999967
0.5313908500000011 0.5434123200000016 0.4639156400000033
0.5389357099999970 0.6303543100000013 0.4847838000000024
0.5992508599999979 0.8255817200000024 0.4649655199999998
0.6020614999999978 0.7806717300000017 0.5672800099999975
0.5679314699999978 0.7509826200000020 0.4791420700000018
0.6513068300000029 0.7513422000000034 0.3012094799999971
0.6955490200000014 0.8011010299999981 0.5099141900000035
0.6523076499999974 0.4165393500000008 0.3462037899999970
0.6799442800000008 0.4012169299999968 0.4977339799999996
0.5341038099999977 0.2881817499999997 0.4054254099999994
0.5677091000000019 0.3630604000000019 0.2929610600000032
0.5335778399999995 0.4154987300000030 0.5737510900000018
0.5535507100000032 0.2966948600000023 0.5792647399999993
0.6125496800000008 0.4334506000000005 0.6694645800000032
0.6329836399999991 0.3557545800000028 0.6676082500000007
0.6355372200000033 0.2685649900000016 0.2910237299999991
0.6204661000000016 0.2197381000000007 0.3765223799999973
0.00000000E+00 0.00000000E+00 0.00000000E+00
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