iterations/neb0_image03_iter10_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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0.3066903699999983 0.4776370800000009 0.5471749299999971
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0.4870733599999966 0.5706275900000009 0.3093544700000024
0.4699024499999993 0.5778756200000004 0.4147472499999978
0.6483911199999994 0.6391279099999991 0.5717269499999986
0.6865806100000000 0.6188495000000032 0.4861878099999970
0.6230465100000018 0.6243860900000016 0.3192453899999990
0.5561060400000031 0.5699919300000005 0.5721693500000029
0.5341234200000002 0.5428807999999989 0.4682137300000022
0.5415364300000007 0.6298173100000000 0.4890113299999967
0.6018092699999968 0.8251174000000034 0.4691013899999987
0.6046197699999993 0.7802211300000010 0.5714787900000005
0.5705065599999983 0.7505477200000001 0.4833252199999976
0.6538876799999969 0.7508899500000012 0.3053108200000025
0.6981152299999991 0.8006373799999977 0.5140545399999965
0.6548737500000001 0.4160863399999997 0.3503843700000004
0.6825365199999993 0.4007639299999965 0.5019633699999986
0.5366669000000002 0.2877601499999969 0.4095844799999995
0.5702647600000006 0.3625993100000002 0.2971382799999986
0.5361348100000001 0.4150016399999998 0.5780247200000019
0.5561498799999995 0.2961692299999967 0.5834884000000002
0.6151118900000014 0.4330142399999986 0.6736285699999982
0.6355727500000015 0.3552985899999968 0.6718398399999970
0.6380563100000032 0.2681044099999994 0.2951667299999983
0.6229896500000009 0.2192670900000024 0.3806189399999980
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