iterations/neb0_image06_iter20_CONTCAR output for 43: 3.6A-->1.6A 715(amd-3) Si-CH2H...H2HC-Si two dimer closed (TSS)
Status:
finished
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
0.3584546700000004 0.5356471500000026 0.4230088400000014
0.3711824800000016 0.4265364600000012 0.5694299099999967
0.4621495600000003 0.5223262599999998 0.4119035399999973
0.5834571600000018 0.3471403100000003 0.3088295299999970
0.5203415599999985 0.3868283300000002 0.4633518099999989
0.5065396099999973 0.2474538100000032 0.2673019599999975
0.3394991600000026 0.5024665799999966 0.5340986300000026
0.4131612400000009 0.5791013199999995 0.4183088099999992
0.2342748599999993 0.4860690699999992 0.5566817999999998
0.1786361200000002 0.4030973699999976 0.6800378100000017
0.2302301799999995 0.3374062099999975 0.5241466499999987
0.5793241800000004 0.3799112900000026 0.4261442000000031
0.5674223899999973 0.2580740200000022 0.2908970100000019
0.6449198700000025 0.5004079500000032 0.4596339799999996
0.6359797900000004 0.6093417200000033 0.5970630999999997
0.6054973600000011 0.6352698000000032 0.4076956299999992
0.3428323500000019 0.5627082000000030 0.6093255400000004
0.2866464700000009 0.4803566200000020 0.5260785099999978
0.4152408500000035 0.6224080599999979 0.5143455899999978
0.4136420700000016 0.6297415599999994 0.3301699900000017
0.6080856000000026 0.3312333100000018 0.4941511199999979
0.6011803499999999 0.4556529400000002 0.4308498400000005
0.5825473299999970 0.2193889600000034 0.3852087900000001
0.5971686199999979 0.2212252699999979 0.2109625900000012
0.2146480700000026 0.4074090699999999 0.5881494500000031
0.2314576699999975 0.3496337300000008 0.4105018699999974
0.1310989899999981 0.4513683999999998 0.6728917800000005
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0.6166697000000028 0.6157921699999989 0.2981269400000031
0.6887961700000034 0.6292513699999986 0.6335873299999975
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0.3334565299999994 0.5726049299999971 0.4009469399999972
0.3665874100000011 0.5949329999999975 0.5962124200000005
0.3678442300000029 0.3855271899999977 0.5209651799999975
0.3585183400000034 0.4084652000000020 0.6339404599999980
0.4068837900000020 0.4375151899999992 0.5777043300000031
0.4944092799999993 0.5484840000000020 0.4118930799999987
0.4606257200000030 0.4908647999999971 0.3517376799999994
0.4621952700000023 0.4890082100000015 0.4698903700000017
0.4406752299999965 0.6515015700000006 0.5241375000000019
0.4424394300000003 0.6375121700000008 0.3024422900000019
0.2285459000000003 0.5317863000000003 0.6346289100000035
0.2088105400000018 0.5127098099999969 0.4789346299999977
0.1657774600000010 0.3313974900000005 0.6881954199999996
0.2016973899999996 0.4274946399999990 0.7619119399999974
0.2761635100000035 0.3157335599999982 0.5490517599999976
0.1971010399999997 0.2840053400000002 0.5445066300000008
0.2578754099999969 0.3737709500000008 0.3826584500000010
0.2029840000000007 0.3604726599999992 0.3766045500000033
0.1309321199999971 0.4990015300000010 0.6965526500000010
0.1084559199999973 0.4454456599999972 0.6230717299999995
0.5639830699999990 0.3789386699999966 0.2629954599999991
0.6187311300000005 0.3522870199999986 0.2891825600000004
0.6058032800000035 0.2842358999999988 0.4764970599999998
0.5020889800000035 0.4188724400000012 0.4169942799999973
0.5184161800000027 0.4102389700000018 0.5299679199999972
0.5029543099999998 0.3383794200000025 0.4657276699999997
0.4972473600000029 0.1943169999999981 0.2627364599999993
0.4972296600000021 0.2715704599999995 0.2039505799999972
0.4861474100000009 0.2702721499999967 0.3201570800000013
0.5854598399999986 0.1710924899999995 0.3829327099999986
0.5839355299999980 0.2170518000000001 0.1523133999999970
0.6669962599999977 0.4717970299999976 0.5402374600000002
0.6766515500000025 0.5001769699999983 0.3829045100000030
0.6084325799999988 0.6713027999999994 0.6034091300000028
0.6195910200000014 0.5563298200000020 0.6583844000000028
0.5557270299999999 0.6345475800000031 0.4151239999999987
0.6225133700000001 0.7041976900000009 0.4254771800000015
0.6002450900000014 0.5776060000000030 0.2678044000000028
0.6482271200000014 0.6195846800000027 0.2736726700000034
0.7101072099999968 0.5919047900000010 0.6511093100000025
0.7057238900000016 0.6682167800000016 0.6061426099999991
0.00000000E+00 0.00000000E+00 0.00000000E+00
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