iterations/neb0_image05_iter17_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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0.2648851200000024 0.3971163699999991 0.2736850200000021
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0.1662440699999976 0.5357152500000026 0.2415107699999979
0.3582928399999972 0.5394956800000017 0.3567955099999978
0.4470285900000022 0.4746540499999981 0.3568145999999999
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0.3746870000000015 0.5594668299999981 0.2669904999999986
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0.3412242300000017 0.3732394800000023 0.4409202800000003
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0.3595365899999976 0.4905981100000005 0.6105856499999973
0.4921502999999987 0.5694565499999982 0.3176768699999997
0.4738062099999993 0.5770082900000020 0.4214095999999969
0.6431633600000026 0.6400707000000025 0.5631253500000000
0.6814473499999991 0.6198816300000018 0.4776727200000010
0.6177635100000032 0.6252715500000008 0.3108235099999987
0.5512253500000028 0.5711987999999977 0.5649957099999980
0.5305126599999994 0.5433994500000026 0.4611593799999980
0.5365712199999990 0.6306608699999998 0.4808741299999966
0.5965722400000004 0.8260898500000025 0.4605965299999966
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0.5652747600000012 0.7515358300000017 0.4748342299999990
0.6486426900000026 0.7518078700000004 0.2968352600000017
0.6928885000000022 0.8016122499999980 0.5055632199999991
0.6496293699999995 0.4170749999999970 0.3418701499999983
0.6772792000000010 0.4017918899999984 0.4934460999999999
0.5314587399999979 0.2887439699999987 0.4011165900000009
0.5650442399999989 0.3635309100000015 0.2887709399999991
0.5308530399999967 0.4160131200000023 0.5696961000000016
0.5509031100000001 0.2970979299999996 0.5750104800000031
0.6098604900000026 0.4339278300000018 0.6651664199999985
0.6303388500000011 0.3562606699999975 0.6633785599999982
0.6328099300000005 0.2690789199999983 0.2866483199999976
0.6177224899999985 0.2202010800000025 0.3720782999999983
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