8.8. Stacking fault tetrohedron array
To create an array of stacking fault tetrahedrons in an FCC single crystal sample,
Step 1:
Use the tool in subdirectory tools/Fcc to creat an FCC single crystal sample:
fcc_reg.lmp, use the shell script in subdirectory tools/para_file_tetrahedron_array to create the parameter file:para_file;
Step 2:
Open terminal, run the following command:
1CryDisGen para_file fcc_reg.lmp
Parameter file
Content of the para_file:
1 Region
2 -x 1 0 0
3 -y 0 1 0
4 -z 0 0 1
5 -lat 3.615
6 -pbc 1 1 1
7
8 nTetrahedron 27
9 Tetrahedron
10 -tc -50 -50 -50
11 -tr 20
12 -tnorm 1 1 1
13 -lxt 1 -1 0
14 -lyt 1 1 -2
15
16 Tetrahedron
17 -tc -50 -50 0
18 -tr 20
19 -tnorm -1 1 -1
20 -lxt -1 -1 0
21 -lyt -1 1 2
22
23 Tetrahedron
24 -tc -50 -50 50
25 -tr 20
26 -tnorm -1 -1 1
27 -lxt -1 1 0
28 -lyt -1 -1 -2
29
30 Tetrahedron
31 -tc -50 0 -50
32 -tr 20
33 -tnorm -1 1 -1
34 -lxt -1 -1 0
35 -lyt -1 1 2
36
37 Tetrahedron
38 -tc -50 0 0
39 -tr 20
40 -tnorm -1 1 -1
41 -lxt -1 -1 0
42 -lyt -1 1 2
43
44 Tetrahedron
45 -tc -50 0 50
46 -tr 20
47 -tnorm 1 -1 -1
48 -lxt 1 1 0
49 -lyt 1 -1 2
50
51 Tetrahedron
52 -tc -50 50 -50
53 -tr 20
54 -tnorm 1 1 1
55 -lxt 1 -1 0
56 -lyt 1 1 -2
57
58 Tetrahedron
59 -tc -50 50 0
60 -tr 20
61 -tnorm -1 1 1
62 -lxt 1 1 0
63 -lyt -1 1 -2
64
65 Tetrahedron
66 -tc -50 50 50
67 -tr 20
68 -tnorm -1 1 -1
69 -lxt -1 -1 0
70 -lyt -1 1 2
71
72 Tetrahedron
73 -tc 0 -50 -50
74 -tr 20
75 -tnorm 1 1 -1
76 -lxt -1 1 0
77 -lyt 1 1 2
78
79 Tetrahedron
80 -tc 0 -50 0
81 -tr 20
82 -tnorm 1 1 -1
83 -lxt -1 1 0
84 -lyt 1 1 2
85
86 Tetrahedron
87 -tc 0 -50 50
88 -tr 20
89 -tnorm 1 1 1
90 -lxt 1 -1 0
91 -lyt 1 1 -2
92
93 Tetrahedron
94 -tc 0 0 -50
95 -tr 20
96 -tnorm -1 1 1
97 -lxt 1 1 0
98 -lyt -1 1 -2
99
100 Tetrahedron
101 -tc 0 0 0
102 -tr 20
103 -tnorm -1 -1 1
104 -lxt -1 1 0
105 -lyt -1 -1 -2
106
107 Tetrahedron
108 -tc 0 0 50
109 -tr 20
110 -tnorm 1 -1 1
111 -lxt -1 -1 0
112 -lyt 1 -1 -2
113
114 Tetrahedron
115 -tc 0 50 -50
116 -tr 20
117 -tnorm 1 -1 1
118 -lxt -1 -1 0
119 -lyt 1 -1 -2
120
121 Tetrahedron
122 -tc 0 50 0
123 -tr 20
124 -tnorm 1 1 -1
125 -lxt -1 1 0
126 -lyt 1 1 2
127
128 Tetrahedron
129 -tc 0 50 50
130 -tr 20
131 -tnorm 1 -1 1
132 -lxt -1 -1 0
133 -lyt 1 -1 -2
134
135 Tetrahedron
136 -tc 50 -50 -50
137 -tr 20
138 -tnorm -1 -1 -1
139 -lxt 1 -1 0
140 -lyt -1 -1 2
141
142 Tetrahedron
143 -tc 50 -50 0
144 -tr 20
145 -tnorm -1 -1 1
146 -lxt -1 1 0
147 -lyt -1 -1 -2
148
149 Tetrahedron
150 -tc 50 -50 50
151 -tr 20
152 -tnorm 1 -1 1
153 -lxt -1 -1 0
154 -lyt 1 -1 -2
155
156 Tetrahedron
157 -tc 50 0 -50
158 -tr 20
159 -tnorm -1 1 1
160 -lxt 1 1 0
161 -lyt -1 1 -2
162
163 Tetrahedron
164 -tc 50 0 0
165 -tr 20
166 -tnorm -1 1 -1
167 -lxt -1 -1 0
168 -lyt -1 1 2
169
170 Tetrahedron
171 -tc 50 0 50
172 -tr 20
173 -tnorm 1 -1 1
174 -lxt -1 -1 0
175 -lyt 1 -1 -2
176
177 Tetrahedron
178 -tc 50 50 -50
179 -tr 20
180 -tnorm -1 1 -1
181 -lxt -1 -1 0
182 -lyt -1 1 2
183
184 Tetrahedron
185 -tc 50 50 0
186 -tr 20
187 -tnorm 1 1 1
188 -lxt 1 -1 0
189 -lyt 1 1 -2
190
191 Tetrahedron
192 -tc 50 50 50
193 -tr 20
194 -tnorm -1 1 1
195 -lxt 1 1 0
196 -lyt -1 1 -2