GRAIN_BOUNDARY_SI_001_011 = { "name": "Si(011)-Si(001), Grain Boundary", "basis": { "elements": [ {"id": 0, "value": "Si"}, {"id": 1, "value": "Si"}, {"id": 2, "value": "Si"}, {"id": 3, "value": "Si"}, {"id": 4, "value": "Si"}, {"id": 5, "value": "Si"}, {"id": 6, "value": "Si"}, {"id": 7, "value": "Si"}, {"id": 8, "value": "Si"}, {"id": 9, "value": "Si"}, {"id": 10, "value": "Si"}, {"id": 11, "value": "Si"}, {"id": 12, "value": "Si"}, {"id": 13, "value": "Si"}, {"id": 14, "value": "Si"}, {"id": 15, "value": "Si"}, {"id": 16, "value": "Si"}, {"id": 17, "value": "Si"}, {"id": 18, "value": "Si"}, {"id": 19, "value": "Si"}, {"id": 20, "value": "Si"}, {"id": 21, "value": "Si"}, {"id": 22, "value": "Si"}, {"id": 23, "value": "Si"}, {"id": 24, "value": "Si"}, {"id": 25, "value": "Si"}, {"id": 26, "value": "Si"}, {"id": 27, "value": "Si"}, {"id": 28, "value": "Si"}, {"id": 29, "value": "Si"}, {"id": 30, "value": "Si"}, {"id": 31, "value": "Si"}, {"id": 32, "value": "Si"}, {"id": 33, "value": "Si"}, {"id": 34, "value": "Si"}, {"id": 35, "value": "Si"}, {"id": 36, "value": "Si"}, {"id": 37, "value": "Si"}, {"id": 38, "value": "Si"}, {"id": 39, "value": "Si"}, {"id": 40, "value": "Si"}, {"id": 41, "value": "Si"}, {"id": 42, "value": "Si"}, {"id": 43, "value": "Si"}, {"id": 44, "value": "Si"}, {"id": 45, "value": "Si"}, {"id": 46, "value": "Si"}, {"id": 47, "value": "Si"}, {"id": 48, "value": "Si"}, {"id": 49, "value": "Si"}, {"id": 50, "value": "Si"}, {"id": 51, "value": "Si"}, {"id": 52, "value": "Si"}, {"id": 53, "value": "Si"}, {"id": 54, "value": "Si"}, {"id": 55, "value": "Si"}, {"id": 56, "value": "Si"}, {"id": 57, "value": "Si"}, {"id": 58, "value": "Si"}, {"id": 59, "value": "Si"}, {"id": 60, "value": "Si"}, {"id": 61, "value": "Si"}, {"id": 62, "value": "Si"}, {"id": 63, "value": "Si"}, {"id": 64, "value": "Si"}, {"id": 65, "value": "Si"}, {"id": 66, "value": "Si"}, {"id": 67, "value": "Si"}, {"id": 68, "value": "Si"}, {"id": 69, "value": "Si"}, {"id": 70, "value": "Si"}, {"id": 71, "value": "Si"}, {"id": 72, "value": "Si"}, {"id": 73, "value": "Si"}, {"id": 74, "value": "Si"}, {"id": 75, "value": "Si"}, {"id": 76, "value": "Si"}, {"id": 77, "value": "Si"}, {"id": 78, "value": "Si"}, {"id": 79, "value": "Si"}, {"id": 80, "value": "Si"}, {"id": 81, "value": "Si"}, {"id": 82, "value": "Si"}, {"id": 83, "value": "Si"}, {"id": 84, "value": "Si"}, {"id": 85, "value": "Si"}, {"id": 86, "value": "Si"}, {"id": 87, "value": "Si"}, {"id": 88, "value": "Si"}, {"id": 89, "value": "Si"}, {"id": 90, "value": "Si"}, {"id": 91, "value": "Si"}, {"id": 92, "value": "Si"}, {"id": 93, "value": "Si"}, {"id": 94, "value": "Si"}, {"id": 95, "value": "Si"}, ], "coordinates": [ {"id": 0, "value": [0.408723941, 0.857142857, 0.5]}, {"id": 1, "value": [0.272482809, 0.821428571, 0.25]}, {"id": 2, "value": [0.136241677, 0.785714286, 0.5]}, {"id": 3, "value": [5.45e-7, 0.75, 0.25]}, {"id": 4, "value": [0.136241677, 0.857142857, 0]}, {"id": 5, "value": [5.45e-7, 0.821428571, 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0.226122483, 0.36571336]}, {"id": 79, "value": [0.608025135, 0.376122483, 0.61571336]}, {"id": 80, "value": [0.800699192, 0.076122483, 0.86571336]}, {"id": 81, "value": [0.800699192, 0.026122483, 0.11571336]}, {"id": 82, "value": [0.800699192, 0.176122483, 0.86571336]}, {"id": 83, "value": [0.800699192, 0.126122483, 0.11571336]}, {"id": 84, "value": [0.608025135, 0.126122483, 0.36571336]}, {"id": 85, "value": [0.608025135, 0.076122483, 0.61571336]}, {"id": 86, "value": [0.608025135, 0.026122483, 0.36571336]}, {"id": 87, "value": [0.608025135, 0.176122483, 0.61571336]}, {"id": 88, "value": [0.800699192, 0.876122483, 0.86571336]}, {"id": 89, "value": [0.800699192, 0.826122483, 0.11571336]}, {"id": 90, "value": [0.800699192, 0.976122483, 0.86571336]}, {"id": 91, "value": [0.800699192, 0.926122483, 0.11571336]}, {"id": 92, "value": [0.608025135, 0.926122483, 0.36571336]}, {"id": 93, "value": [0.608025135, 0.876122483, 0.61571336]}, {"id": 94, "value": [0.608025135, 0.826122483, 0.36571336]}, {"id": 95, "value": [0.608025135, 0.976122483, 0.61571336]}, ], "units": "crystal", "labels": [ {"id": 0, "value": 0}, {"id": 1, "value": 0}, {"id": 2, "value": 0}, {"id": 3, "value": 0}, {"id": 4, "value": 0}, {"id": 5, "value": 0}, {"id": 6, "value": 0}, {"id": 7, "value": 0}, {"id": 8, "value": 0}, {"id": 9, "value": 0}, {"id": 10, "value": 0}, {"id": 11, "value": 0}, {"id": 12, "value": 0}, {"id": 13, "value": 0}, {"id": 14, "value": 0}, {"id": 15, "value": 0}, {"id": 16, "value": 0}, {"id": 17, "value": 0}, {"id": 18, "value": 0}, {"id": 19, "value": 0}, {"id": 20, "value": 0}, {"id": 21, "value": 0}, {"id": 22, "value": 0}, {"id": 23, "value": 0}, {"id": 24, "value": 0}, {"id": 25, "value": 0}, {"id": 26, "value": 0}, {"id": 27, "value": 0}, {"id": 28, "value": 0}, {"id": 29, "value": 0}, {"id": 30, "value": 0}, {"id": 31, "value": 0}, {"id": 32, "value": 0}, {"id": 33, "value": 0}, {"id": 34, "value": 0}, {"id": 35, "value": 0}, {"id": 36, "value": 0}, {"id": 37, "value": 0}, {"id": 38, "value": 0}, {"id": 39, "value": 0}, {"id": 40, "value": 0}, {"id": 41, "value": 0}, {"id": 42, "value": 0}, {"id": 43, "value": 0}, {"id": 44, "value": 0}, {"id": 45, "value": 0}, {"id": 46, "value": 0}, {"id": 47, "value": 0}, {"id": 48, "value": 0}, {"id": 49, "value": 0}, {"id": 50, "value": 0}, {"id": 51, "value": 0}, {"id": 52, "value": 0}, {"id": 53, "value": 0}, {"id": 54, "value": 0}, {"id": 55, "value": 0}, {"id": 56, "value": 1}, {"id": 57, "value": 1}, {"id": 58, "value": 1}, {"id": 59, "value": 1}, {"id": 60, "value": 1}, {"id": 61, "value": 1}, {"id": 62, "value": 1}, {"id": 63, "value": 1}, {"id": 64, "value": 1}, {"id": 65, "value": 1}, {"id": 66, "value": 1}, {"id": 67, "value": 1}, {"id": 68, "value": 1}, {"id": 69, "value": 1}, {"id": 70, "value": 1}, {"id": 71, "value": 1}, {"id": 72, "value": 1}, {"id": 73, "value": 1}, {"id": 74, "value": 1}, {"id": 75, "value": 1}, {"id": 76, "value": 1}, {"id": 77, "value": 1}, {"id": 78, "value": 1}, {"id": 79, "value": 1}, {"id": 80, "value": 1}, {"id": 81, "value": 1}, {"id": 82, "value": 1}, {"id": 83, "value": 1}, {"id": 84, "value": 1}, {"id": 85, "value": 1}, {"id": 86, "value": 1}, {"id": 87, "value": 1}, {"id": 88, "value": 1}, {"id": 89, "value": 1}, {"id": 90, "value": 1}, {"id": 91, "value": 1}, {"id": 92, "value": 1}, {"id": 93, "value": 1}, {"id": 94, "value": 1}, {"id": 95, "value": 1}, ], "constraints": [], }, "lattice": { "a": 10.03508222, "b": 38.281346922, "c": 5.468763846, "alpha": 90, "beta": 90, "gamma": 90, "units": {"length": "angstrom", "angle": "degree"}, "type": "TRI", }, } GRAIN_BOUNDARY_SI_001_011_GH = { "name": "Si(011)-Si(001), Grain Boundary", "basis": { "elements": [ {"id": 0, "value": "Si"}, {"id": 1, "value": "Si"}, {"id": 2, "value": "Si"}, {"id": 3, "value": "Si"}, {"id": 4, "value": "Si"}, {"id": 5, "value": "Si"}, {"id": 6, "value": "Si"}, {"id": 7, "value": "Si"}, {"id": 8, "value": "Si"}, {"id": 9, "value": "Si"}, {"id": 10, "value": "Si"}, {"id": 11, "value": "Si"}, {"id": 12, "value": "Si"}, {"id": 13, "value": "Si"}, {"id": 14, "value": "Si"}, {"id": 15, "value": "Si"}, {"id": 16, "value": "Si"}, {"id": 17, "value": "Si"}, {"id": 18, "value": "Si"}, {"id": 19, "value": "Si"}, {"id": 20, "value": "Si"}, {"id": 21, "value": "Si"}, {"id": 22, "value": "Si"}, {"id": 23, "value": "Si"}, {"id": 24, "value": "Si"}, {"id": 25, "value": "Si"}, {"id": 26, "value": "Si"}, {"id": 27, "value": "Si"}, {"id": 28, "value": "Si"}, {"id": 29, "value": "Si"}, {"id": 30, "value": "Si"}, {"id": 31, "value": "Si"}, {"id": 32, "value": "Si"}, {"id": 33, "value": "Si"}, {"id": 34, "value": "Si"}, {"id": 35, "value": "Si"}, {"id": 36, "value": "Si"}, {"id": 37, "value": "Si"}, {"id": 38, "value": "Si"}, {"id": 39, "value": "Si"}, {"id": 40, "value": "Si"}, {"id": 41, "value": "Si"}, {"id": 42, "value": "Si"}, {"id": 43, "value": "Si"}, {"id": 44, "value": "Si"}, {"id": 45, "value": "Si"}, {"id": 46, "value": "Si"}, {"id": 47, "value": "Si"}, {"id": 48, "value": "Si"}, {"id": 49, "value": "Si"}, {"id": 50, "value": "Si"}, {"id": 51, "value": "Si"}, {"id": 52, "value": "Si"}, {"id": 53, "value": "Si"}, {"id": 54, "value": "Si"}, {"id": 55, "value": "Si"}, {"id": 56, "value": "Si"}, {"id": 57, "value": "Si"}, {"id": 58, "value": "Si"}, {"id": 59, "value": "Si"}, {"id": 60, "value": "Si"}, {"id": 61, "value": "Si"}, {"id": 62, "value": "Si"}, {"id": 63, "value": "Si"}, {"id": 64, "value": "Si"}, {"id": 65, "value": "Si"}, {"id": 66, "value": "Si"}, {"id": 67, "value": "Si"}, {"id": 68, "value": "Si"}, {"id": 69, "value": "Si"}, {"id": 70, "value": "Si"}, {"id": 71, "value": "Si"}, {"id": 72, "value": "Si"}, {"id": 73, "value": "Si"}, {"id": 74, "value": "Si"}, {"id": 75, "value": "Si"}, {"id": 76, "value": "Si"}, {"id": 77, "value": "Si"}, {"id": 78, "value": "Si"}, {"id": 79, "value": "Si"}, {"id": 80, "value": "Si"}, {"id": 81, "value": "Si"}, {"id": 82, "value": "Si"}, {"id": 83, "value": "Si"}, {"id": 84, "value": "Si"}, {"id": 85, "value": "Si"}, {"id": 86, "value": "Si"}, {"id": 87, "value": "Si"}, {"id": 88, "value": "Si"}, {"id": 89, "value": "Si"}, {"id": 90, "value": "Si"}, {"id": 91, "value": "Si"}, {"id": 92, "value": "Si"}, {"id": 93, "value": "Si"}, {"id": 94, "value": "Si"}, {"id": 95, "value": "Si"}, ], "coordinates": [ {"id": 0, "value": [0.408723941, 0, 0.5]}, {"id": 1, "value": [0.272482809, 0.035714286, 0.25]}, {"id": 2, "value": [0.136241677, 0.071428571, 0.5]}, {"id": 3, "value": [5.45e-7, 0.107142857, 0.25]}, {"id": 4, "value": [0.136241677, 0, 0]}, {"id": 5, "value": [5.45e-7, 0.035714286, 0.75]}, {"id": 6, "value": [0.408723941, 0.071428571, 0]}, {"id": 7, "value": [0.272482809, 0.107142857, 0.75]}, {"id": 8, "value": [0.408723941, 0.142857143, 0.5]}, {"id": 9, "value": [0.272482809, 0.178571429, 0.25]}, {"id": 10, "value": [0.136241677, 0.214285714, 0.5]}, {"id": 11, "value": [5.45e-7, 0.25, 0.25]}, {"id": 12, "value": [0.136241677, 0.142857143, 0]}, {"id": 13, "value": [5.45e-7, 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