./iterations/neb0_image04_iter3_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
0.2102529699999991 0.5277513099999993 0.3182137800000007
0.2622164799999993 0.3975962000000024 0.2693463900000026
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0.4725661100000025 0.5774029299999981 0.4192390300000000
0.6458044500000000 0.6395977099999968 0.5675699000000023
0.6839991299999966 0.6192493100000007 0.4820345099999983
0.6204861800000003 0.6248749000000018 0.3150965999999968
0.5535394899999986 0.5704115799999983 0.5677572999999967
0.5313908500000011 0.5434123200000016 0.4639156400000033
0.5389357099999970 0.6303543100000013 0.4847838000000024
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0.6955490200000014 0.8011010299999981 0.5099141900000035
0.6523076499999974 0.4165393500000008 0.3462037899999970
0.6799442800000008 0.4012169299999968 0.4977339799999996
0.5341038099999977 0.2881817499999997 0.4054254099999994
0.5677091000000019 0.3630604000000019 0.2929610600000032
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0.5535507100000032 0.2966948600000023 0.5792647399999993
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0.6355372200000033 0.2685649900000016 0.2910237299999991
0.6204661000000016 0.2197381000000007 0.3765223799999973
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