iterations/neb0_image03_iter20_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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0.2596378799999997 0.3980591799999971 0.2652454699999964
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0.3530863699999998 0.5404357800000028 0.3483388399999967
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0.2544796399999996 0.3750383499999970 0.3310545900000008
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0.1029326900000029 0.4632389499999974 0.1652282499999984
0.1139015600000022 0.4392971899999978 0.2774748499999973
0.1518443599999983 0.4172004099999995 0.1916860999999983
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0.3694854700000008 0.5604645499999990 0.2585006799999974
0.3519470900000030 0.5993380199999976 0.4094173000000012
0.4662635399999999 0.4236226299999970 0.4015524400000032
0.4443411600000005 0.4585313299999996 0.2520977599999981
0.3359795800000001 0.3741861800000024 0.4324194599999984
0.4069163799999984 0.3890725500000016 0.5119647000000001
0.3066892800000005 0.4776169699999997 0.5471558999999999
0.3542861999999971 0.4915519199999991 0.6020846500000019
0.4870961600000001 0.5705686800000009 0.3092046000000011
0.4697758300000032 0.5778868499999987 0.4147436900000017
0.6483902299999968 0.6391263699999996 0.5717026599999997
0.6866118399999976 0.6188829399999989 0.4861638100000008
0.6230255700000029 0.6243646699999985 0.3192288400000010
0.5561374400000005 0.5700419499999967 0.5723471299999972
0.5342110500000032 0.5427912000000035 0.4683190200000027
0.5415505300000021 0.6297995500000013 0.4890570999999966
0.6018048099999973 0.8251234000000025 0.4690925199999967
0.6046158899999980 0.7802385500000000 0.5714479800000021
0.5705097600000002 0.7505640600000021 0.4833287200000029
0.6538851600000015 0.7508798400000032 0.3052965700000030
0.6981067099999976 0.8006888900000035 0.5140875800000018
0.6548491799999994 0.4160933599999979 0.3503966399999996
0.6825141799999983 0.4007873999999987 0.5019278199999988
0.5366492599999972 0.2877736700000000 0.4095945400000005
0.5702597699999998 0.3625842200000022 0.2972004499999983
0.5360808499999976 0.4150003000000027 0.5780381599999984
0.5561429500000017 0.2961360299999996 0.5834612000000021
0.6150932400000002 0.4329780300000010 0.6735884699999986
0.6355560000000011 0.3553329100000013 0.6718266099999965
0.6380388099999976 0.2681232300000005 0.2950919399999989
0.6229593400000013 0.2192359900000014 0.3805728900000034
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