iterations/neb0_image04_iter15_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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0.3673993499999995 0.4364565400000018 0.5688880299999965
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0.2541038900000032 0.3836748100000023 0.3821095899999989
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0.1046500400000028 0.4553645599999996 0.6224949400000028
0.5677509900000004 0.3690197299999980 0.2634748799999969
0.6225073100000031 0.3423941900000003 0.2898397800000012
0.6094810399999986 0.2745767400000005 0.4769474200000019
0.5042296199999967 0.4120996700000035 0.4184517400000018
0.5219376499999981 0.4009142900000029 0.5304942200000013
0.5063782399999965 0.3304092300000008 0.4654680100000022
0.5010056599999970 0.1844466499999982 0.2632768499999969
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0.5892052299999975 0.1611676699999975 0.3835272099999969
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0.6263223400000015 0.6942551300000019 0.4261777600000016
0.6040788999999975 0.5677148999999986 0.2684830000000034
0.6519959700000015 0.6096718200000026 0.2742646600000000
0.7139039300000007 0.5819621099999992 0.6516846000000029
0.7095034199999972 0.6583373499999965 0.6065895500000025
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