iterations/neb0_image04_iter28_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
0.2103696499999970 0.5277568599999967 0.3182807800000020
0.2622828599999991 0.3975102899999996 0.2695641299999991
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0.1636637800000003 0.5362192600000029 0.2373287400000024
0.3556554299999988 0.5400335300000023 0.3526079499999994
0.4445903200000032 0.4753244699999968 0.3526937800000027
0.3700445999999999 0.4227887999999993 0.4771068399999976
0.6107234300000002 0.5743847700000018 0.4468751599999976
0.6475359399999974 0.7248266699999988 0.4493983300000011
0.6407346100000026 0.4216136399999968 0.4429452700000027
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0.6951060399999989 0.7662429299999971 0.4651022299999994
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0.1987247599999975 0.4991599600000001 0.3767422700000012
0.2182172199999997 0.5786046699999972 0.3424068699999978
0.2513181200000005 0.5439758600000033 0.1478644500000001
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0.2940058499999978 0.3784891700000017 0.2427859200000029
0.2355084200000022 0.3805032200000014 0.2248046400000021
0.1055930799999985 0.4627759299999994 0.1695589899999987
0.1165476400000003 0.4388380700000027 0.2818045699999985
0.1544748600000005 0.4166797500000001 0.1960038599999976
0.1696049600000009 0.5852197099999970 0.0998500299999989
0.0999134600000033 0.5848776400000020 0.2904205099999970
0.3721212900000026 0.5599986900000005 0.2627642499999965
0.3545851200000030 0.5988828300000009 0.4137495900000019
0.4689112599999987 0.4233344700000004 0.4057105099999987
0.4468773400000003 0.4575928900000008 0.2559922800000010
0.3386203700000010 0.3736670099999984 0.4367058699999973
0.4095841299999989 0.3885906399999968 0.5162000600000027
0.3092985099999979 0.4771009000000035 0.5514041100000000
0.3569126200000028 0.4910816900000015 0.6064114799999984
0.4896187399999974 0.5697228800000005 0.3130572500000000
0.4713945299999978 0.5775053500000027 0.4179864700000024
0.6457957100000016 0.6396109300000035 0.5673619200000033
0.6841717399999965 0.6195168100000004 0.4818796599999970
0.6203131299999995 0.6247613199999975 0.3149951600000023
0.5538685200000018 0.5708681600000034 0.5690811199999999
0.5325241800000029 0.5428403599999996 0.4650212600000003
0.5391197599999984 0.6301864200000011 0.4851451600000019
0.5991690500000004 0.8256498699999995 0.4647727099999983
0.6019831600000032 0.7807535999999970 0.5670895100000024
0.5678297500000014 0.7511026900000033 0.4790236199999995
0.6512510599999999 0.7513564699999975 0.3009822699999987
0.6954680899999985 0.8011953600000012 0.5098076700000007
0.6522297300000020 0.4166165099999972 0.3461758999999986
0.6799126900000019 0.4012565199999969 0.4977252799999974
0.5340260999999984 0.2882716800000011 0.4052387799999977
0.5676117100000013 0.3630922700000028 0.2928194500000032
0.5334369300000006 0.4154226200000011 0.5738276000000013
0.5535325499999999 0.2966099799999995 0.5791242000000025
0.6124605099999982 0.4334740899999971 0.6692644399999992
0.6329216500000001 0.3558338400000025 0.6675586400000029
0.6353970300000000 0.2685793899999993 0.2907550199999989
0.6202970000000008 0.2196862899999985 0.3762075200000012
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