iterations/neb0_image03_iter68_CONTCAR output for 3: !!! 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
terminated
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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0.1612169899999998 0.5367189899999971 0.2331170100000008
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0.3540846200000018 0.4915907399999995 0.6018455700000018
0.4872404899999978 0.5697395700000030 0.3078650100000004
0.4674853100000007 0.5786556799999971 0.4119783900000016
0.6491068999999996 0.6397149499999983 0.5716429900000009
0.6873085200000020 0.6198049500000025 0.4861380800000035
0.6226072400000007 0.6241821899999991 0.3194237299999969
0.5573262599999964 0.5711100899999977 0.5749231400000028
0.5353594099999981 0.5415465100000034 0.4721885399999977
0.5416494899999975 0.6290474600000024 0.4900774700000028
0.6017349700000025 0.8253573200000019 0.4685735600000029
0.6047966400000035 0.7804728699999970 0.5709072499999976
0.5705980600000018 0.7506721900000031 0.4830113299999965
0.6540172500000025 0.7508764700000015 0.3048956700000005
0.6980153599999994 0.8015904499999991 0.5145316999999991
0.6548279900000011 0.4161498300000019 0.3504771099999999
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0.5364716999999999 0.2884150599999984 0.4099835199999973
0.5700381600000028 0.3633025000000032 0.2970599000000007
0.5356698800000004 0.4140978200000021 0.5784068500000004
0.5563631300000011 0.2957579300000006 0.5834116799999975
0.6145617800000025 0.4313598900000031 0.6731104699999975
0.6346128100000001 0.3567474899999965 0.6713815800000020
0.6376862400000007 0.2682611600000016 0.2936856399999996
0.6222278899999978 0.2187146899999988 0.3792448100000030
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