iterations/neb0_image06_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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0.2675260899999969 0.3966498799999982 0.2779434699999968
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0.1688434699999988 0.5352386699999983 0.2457189900000003
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0.4945733799999985 0.5690180599999977 0.3223119900000029
0.4757736700000024 0.5765735299999974 0.4244881400000011
0.6405140000000031 0.6405526100000003 0.5588939399999973
0.6787779200000017 0.6203281599999997 0.4734521900000033
0.6151732900000013 0.6258102800000032 0.3065553699999981
0.5486520199999987 0.5716398699999985 0.5609231199999982
0.5288699199999982 0.5438409100000001 0.4577837499999973
0.5340471100000030 0.6309735199999977 0.4766534199999981
0.5939401899999979 0.8265752100000014 0.4563607400000009
0.5967594399999996 0.7816576000000026 0.5587256100000033
0.5626330899999985 0.7520057699999967 0.4705936800000003
0.6460222199999990 0.7523137800000015 0.2925970399999969
0.6902536899999987 0.8020831899999976 0.5013233199999974
0.6470097500000023 0.4175523099999978 0.3375944399999966
0.6746610200000021 0.4022733299999999 0.4892067500000010
0.5288476099999997 0.2892409800000024 0.3968890200000033
0.5624180699999997 0.3640567300000015 0.2845038099999968
0.5282695699999991 0.4165114899999978 0.5655626300000023
0.5482667300000017 0.2975742499999967 0.5708585699999986
0.6072606299999990 0.4345271299999993 0.6610363500000034
0.6278161600000018 0.3566475100000019 0.6592203800000007
0.6301759099999984 0.2695616999999970 0.2824712299999987
0.6151036799999972 0.2207551799999976 0.3678207700000016
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