iterations/neb0_image09_iter65_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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0.6605263699999995 0.6566231400000007 0.5375311499999995
0.7016702100000032 0.6598914899999997 0.4718863299999967
0.5877026200000017 0.6209462799999983 0.3095772100000005
0.5982372200000015 0.6185691399999982 0.6009798700000033
0.5885434300000014 0.5323203399999983 0.6122025399999984
0.5501073200000022 0.5731771499999994 0.5331660499999984
0.5826610000000016 0.8232360000000014 0.4318296499999974
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0.6796192999999988 0.8182555699999980 0.4791005399999975
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0.5191574400000007 0.4179901700000030 0.5617301899999987
0.5358556699999966 0.2988450799999995 0.5481304500000022
0.5942510699999985 0.4330284699999964 0.6431589500000001
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0.6151268200000004 0.2719000900000026 0.2579348000000010
0.5997531900000013 0.2213956599999989 0.3407455299999995
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