iterations/neb0_image05_iter8_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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0.3692522600000032 0.4316064499999968 0.5691602599999968
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0.2559735700000019 0.3788417600000002 0.3823604000000032
0.2010514799999967 0.3655156499999990 0.3763033899999968
0.1289856799999995 0.5040854499999980 0.6963089199999999
0.1065024299999990 0.4505127099999982 0.6227672899999988
0.5658955700000021 0.3738461200000032 0.2632031799999979
0.6206391500000024 0.3472196900000029 0.2895808099999968
0.6076165099999997 0.2794452899999982 0.4766911800000031
0.5025550800000005 0.4165909199999973 0.4183010300000021
0.5200888099999972 0.4057322700000014 0.5301200600000016
0.5045311000000012 0.3352210199999988 0.4652155799999989
0.4991416100000023 0.1892820899999990 0.2629920899999973
0.4992165399999990 0.2665405099999987 0.2042647700000018
0.4880434800000018 0.2652753300000015 0.3203821899999966
0.5873293499999974 0.1660272199999966 0.3832731400000000
0.5858796799999979 0.2119843600000024 0.1526579499999983
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0.6215189699999968 0.5512486300000035 0.6590278700000027
0.5577417200000028 0.6293970299999998 0.4155028899999991
0.6244579800000025 0.6990741099999980 0.4259641900000020
0.6022142500000029 0.5724042299999965 0.2681421500000027
0.6502863500000018 0.6145193400000011 0.2738810700000016
0.7119854800000027 0.5869089600000024 0.6513649299999997
0.7075589900000026 0.6629952500000016 0.6064203500000005
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