iterations/neb0_image03_iter29_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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0.4421524899999980 0.4758852900000008 0.3487274599999992
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0.4694983999999991 0.5779020399999979 0.4145451999999992
0.6484007000000034 0.6391444799999988 0.5716461199999969
0.6866808700000036 0.6189882299999994 0.4861181799999983
0.6229794400000017 0.6243286699999970 0.3191944000000007
0.5562253100000021 0.5701804699999968 0.5726245099999971
0.5344143900000020 0.5426378299999968 0.4686127499999984
0.5415823700000004 0.6297346599999969 0.4891573000000022
0.6017923200000013 0.8251519700000003 0.4690582100000000
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0.5704834100000014 0.7505824699999977 0.4833188300000018
0.6538884699999983 0.7508893099999980 0.3052338800000030
0.6980846599999992 0.8007364500000023 0.5140730000000033
0.6548259799999983 0.4161223500000020 0.3504434199999977
0.6825264799999999 0.4008119699999995 0.5019881300000009
0.5366222999999977 0.2878505799999971 0.4096258300000031
0.5702306499999992 0.3626436099999992 0.2972021499999968
0.5360385600000015 0.4149281600000023 0.5781585000000007
0.5561578200000028 0.2960869099999996 0.5835137799999970
0.6150413800000010 0.4330690700000019 0.6735992400000015
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0.6379585299999988 0.2681306799999987 0.2950179999999989
0.6228809999999996 0.2192165000000017 0.3803997899999985
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