iterations/neb0_image07_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
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0.3731243100000015 0.4214584500000029 0.5697393900000023
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0.4145752700000003 0.5752999799999969 0.4181570399999970
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0.1805922799999991 0.3980066499999992 0.6802718100000007
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0.2598594600000013 0.3687177899999980 0.3828736800000030
0.2049105299999994 0.3554137100000005 0.3768281199999990
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0.1103915400000020 0.4403819799999980 0.6233758500000022
0.5620674899999969 0.3840322400000034 0.2627882299999982
0.6168237999999988 0.3573577800000010 0.2887687400000019
0.6039485200000030 0.2890742200000034 0.4763706600000006
0.5018562400000022 0.4207385799999983 0.4156851400000008
0.5167659099999966 0.4147181800000013 0.5296899900000014
0.5012953800000020 0.3415480999999971 0.4663147500000022
0.4953216800000035 0.1994241599999995 0.2624766300000019
0.4952928000000014 0.2766583599999990 0.2036869699999997
0.4841856099999973 0.2753525600000017 0.3199049899999977
0.5835057700000021 0.1762212699999992 0.3826761199999993
0.5819842300000033 0.2221275200000008 0.1519827300000003
0.6650304400000024 0.4768906999999984 0.5398316200000011
0.6747046699999970 0.5052521499999969 0.3825350600000021
0.6064900900000012 0.6763821500000020 0.6031098699999973
0.6176373799999979 0.5614306200000030 0.6580693300000036
0.5537637500000017 0.6395736600000035 0.4148205700000034
0.6205387899999977 0.7092491699999997 0.4252147099999988
0.5983507400000008 0.5827954100000028 0.2675745000000020
0.6462148499999998 0.6246655799999985 0.2734801599999983
0.7082425099999980 0.5968795100000008 0.6508905399999989
0.7038263299999983 0.6733966299999992 0.6058335099999965
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