iterations/neb0_image05_iter42_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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0.1693094399999993 0.5343258799999973 0.2447260799999995
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0.4394569700000019 0.4676862499999999 0.3376992600000008
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0.6155824000000010 0.5805211799999981 0.4516357099999979
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0.3609659600000015 0.4913490699999983 0.6147656699999970
0.4870063700000031 0.5581477799999988 0.3109318699999974
0.4318936299999976 0.5836724899999979 0.3717850299999981
0.6438842800000018 0.6413479300000020 0.5564197799999988
0.6881488499999975 0.6279792899999990 0.4741765799999982
0.6121891199999965 0.6229988400000011 0.3088801899999964
0.5649532500000021 0.5865137199999992 0.6057636099999968
0.5682592200000016 0.5269655000000029 0.5035371499999997
0.5424290999999997 0.6237672700000019 0.4937641799999994
0.5940062700000013 0.8272167399999972 0.4554929900000033
0.5970171499999992 0.7828102499999972 0.5587921699999967
0.5629038300000033 0.7533106400000023 0.4708561099999997
0.6462233000000026 0.7517207100000007 0.2899801200000027
0.6909076199999973 0.8036390999999981 0.5004376500000021
0.6469883400000001 0.4185151800000000 0.3373915000000025
0.6757205299999995 0.4033596900000020 0.4906083799999976
0.5290039200000010 0.2905776500000030 0.3981219599999974
0.5624564599999999 0.3647401500000029 0.2857221200000026
0.5273501499999966 0.4151999300000000 0.5713436200000004
0.5488801699999968 0.2957403500000026 0.5712755200000004
0.6059385499999976 0.4338561699999985 0.6609579900000000
0.6272672300000011 0.3573350300000016 0.6600458300000014
0.6287326699999980 0.2694283200000029 0.2803644099999971
0.6132450599999970 0.2183514800000026 0.3638082599999990
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