iterations/neb0_image03_iter13_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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0.2616038399999994 0.4912565899999990 0.2722364999999982
0.1609861800000019 0.5367256299999994 0.2330210000000008
0.3530882599999998 0.5404621200000008 0.3483155999999994
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0.3674336300000007 0.4233467500000003 0.4726822399999975
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0.4662611199999986 0.4236069000000029 0.4016113899999993
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0.4068994499999974 0.3890870999999976 0.5119810999999999
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0.3543030299999970 0.4915459500000026 0.6020973099999978
0.4870793500000019 0.5706302700000023 0.3092700300000004
0.4699391099999985 0.5778724700000026 0.4149128500000003
0.6483888599999972 0.6391254600000025 0.5717349800000022
0.6865859799999967 0.6188190199999966 0.4861967699999994
0.6230514900000017 0.6243829000000005 0.3192618799999991
0.5561116299999966 0.5699672100000015 0.5721017400000008
0.5340345199999987 0.5428921800000026 0.4681454400000007
0.5415291699999969 0.6298303100000027 0.4889965899999993
0.6018186800000009 0.8251148599999993 0.4691201999999990
0.6046291999999980 0.7802134900000013 0.5714682099999990
0.5705130799999978 0.7505335900000034 0.4833265400000002
0.6538873200000026 0.7508765999999980 0.3053463500000007
0.6981208799999976 0.8006429400000030 0.5140816500000014
0.6548766599999993 0.4160763300000028 0.3503862900000030
0.6825269300000016 0.4007584300000033 0.5019355599999997
0.5366704200000001 0.2877383499999979 0.4096003000000010
0.5702760100000006 0.3625905600000010 0.2971546599999968
0.5361384400000020 0.4150128100000003 0.5779902399999983
0.5561418400000022 0.2961870399999995 0.5834719200000009
0.6151215800000003 0.4330098900000010 0.6736409600000002
0.6355800899999977 0.3552843800000005 0.6718256099999991
0.6380786200000017 0.2681011800000022 0.2951787900000014
0.6230098099999992 0.2192659999999975 0.3806468000000010
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