iterations/neb0_image08_iter2_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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0.5750265400000032 0.3900343999999976 0.4253595099999998
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0.6414088100000015 0.5099265699999975 0.4590289400000032
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0.2320785699999988 0.5224506799999986 0.6352400999999972
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0.1344763399999991 0.4896514499999967 0.6971034000000031
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0.5603915700000002 0.3882434799999999 0.2624253500000009
0.6151344399999985 0.3616211800000002 0.2887788299999983
0.6021057199999973 0.2938318699999982 0.4758931799999999
0.4966924200000022 0.4316576499999982 0.4174399099999988
0.5145614500000022 0.4202229799999984 0.5295018300000010
0.4989899099999988 0.3498303800000002 0.4643684699999966
0.4936171100000024 0.2036814000000007 0.2621632700000021
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0.5817945000000009 0.1804108600000021 0.3824846300000004
0.5803648999999993 0.2263811899999979 0.1518505499999989
0.6634140099999968 0.4811144600000006 0.5396704899999989
0.6731407099999984 0.5095002999999991 0.3823821100000018
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0.5522917300000003 0.6437491900000012 0.4147987300000011
0.6189568599999973 0.7134394699999973 0.4253220399999975
0.5967628100000013 0.5868736899999973 0.2675231400000015
0.6447003700000025 0.6289306899999971 0.2732295100000002
0.7065503500000005 0.6012172399999969 0.6506171899999984
0.7021290100000002 0.6775237900000022 0.6054989000000006
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