iterations/neb0_image06_iter11_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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0.2675005999999982 0.3966424899999978 0.2779026999999985
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0.3438153800000023 0.3727694299999982 0.4451375000000013
0.4147438199999982 0.3876658800000001 0.5246313999999970
0.3145419299999972 0.4761900100000034 0.5598529299999981
0.3621359099999992 0.4900924499999988 0.6147740799999966
0.4945936399999979 0.5690145599999994 0.3221559500000026
0.4760962200000023 0.5765416799999983 0.4250989000000018
0.6405386200000009 0.6405501400000020 0.5589455100000009
0.6788053399999967 0.6203057600000008 0.4734940600000002
0.6151900300000008 0.6257840299999984 0.3066087799999977
0.5486268599999988 0.5715928099999985 0.5607919699999968
0.5283387400000024 0.5438762100000005 0.4573286400000001
0.5340181299999998 0.6309922000000014 0.4766415899999998
0.5939690399999975 0.8265695799999975 0.4564064300000013
0.5967864599999970 0.7816511500000018 0.5587561600000015
0.5626616400000017 0.7519928800000031 0.4706298799999971
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0.6902782100000024 0.8020843999999983 0.5013763600000019
0.6470322999999993 0.4175381000000016 0.3376431200000027
0.6746800100000030 0.4022543600000006 0.4892278599999997
0.5288667100000026 0.2892150699999974 0.3969259400000027
0.5624463899999981 0.3640360200000003 0.2845417699999970
0.5282841100000013 0.4165122699999984 0.5655224099999998
0.5482850900000003 0.2975914399999979 0.5708537800000002
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0.6302236599999986 0.2695548299999970 0.2824895800000036
0.6151490299999978 0.2207168099999990 0.3679054600000029
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