iterations/neb0_image08_iter61_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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0.6132057599999996 0.5790505699999997 0.4401704300000020
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0.3961382600000007 0.5992146999999974 0.2955626600000016
0.6530676000000000 0.6528464499999984 0.5376867900000022
0.6987274499999998 0.6539357699999968 0.4724513600000009
0.5909503800000024 0.6219170399999996 0.3020850099999990
0.5889115299999972 0.6152866899999978 0.5980264800000015
0.5643573500000016 0.5256420099999985 0.5728849899999986
0.5395111799999981 0.5899823600000005 0.5098568700000001
0.5820727899999980 0.8259681500000013 0.4333598999999992
0.5846010100000001 0.7833039799999995 0.5356869900000021
0.5519450500000005 0.7519267200000002 0.4469371799999990
0.6318244200000009 0.7558692100000002 0.2643909100000030
0.6796237900000008 0.8157440000000022 0.4833813300000003
0.6339067400000005 0.4150800099999969 0.3158756400000016
0.6645015799999996 0.3946963400000030 0.4672671599999987
0.5156686699999966 0.2908525499999968 0.3762789000000026
0.5487563599999987 0.3665473499999976 0.2645982499999988
0.5179164700000030 0.4180869999999999 0.5574167500000016
0.5357003399999982 0.2985586200000014 0.5495812899999990
0.5943213600000021 0.4347232800000000 0.6427465699999999
0.6186878800000031 0.3592176300000034 0.6415988400000003
0.6156454300000007 0.2718393999999975 0.2590636999999987
0.6003128799999971 0.2211405999999982 0.3428365199999988
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