iterations/neb0_image08_iter1_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
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0.5750319899999994 0.3900410500000007 0.4253501099999966
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0.5603928700000012 0.3882400500000003 0.2624264999999966
0.6151357099999970 0.3616177099999973 0.2887792900000008
0.6021070299999991 0.2938278499999996 0.4758932000000016
0.4966605799999968 0.4317164599999970 0.4174273300000024
0.5145614699999967 0.4202205799999987 0.5295011199999990
0.4989891099999966 0.3498317199999974 0.4643664099999967
0.4936183499999984 0.2036780399999998 0.2621632700000021
0.4937248199999971 0.2809640099999982 0.2034435999999999
0.4825326899999993 0.2797102999999979 0.3195469500000030
0.5817955400000017 0.1804075299999965 0.3824849100000023
0.5803662000000003 0.2263777900000008 0.1518510499999977
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0.5522935600000025 0.6437459699999977 0.4148004700000030
0.6189583999999968 0.7134363600000029 0.4253245000000021
0.5967646300000027 0.5868708499999968 0.2675255400000012
0.6447010600000027 0.6289270500000015 0.2732310299999980
0.7065523200000001 0.6012127199999995 0.6506183400000012
0.7021307600000029 0.6775215500000016 0.6054983699999994
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