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/[conograph]/BLDConograph_ver1/trunk/sample/sample5(Hexagonal;23.1,23.1,10.7,90,90,120)/output/M402-pf-119673.out.xml

Contents of /BLDConograph_ver1/trunk/sample/sample5(Hexagonal;23.1,23.1,10.7,90,90,120)/output/M402-pf-119673.out.xml

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Revision 32 - (show annotations) (download) (as text)
Sat Aug 6 01:34:09 2016 UTC (7 years, 7 months ago) by rtomiyasu
File MIME type: application/xml
File size: 6024 byte(s) 
Monoclinic(B) -> Monoclinic(C)
1 <?xml version="1.0" encoding="UTF-8"?>
2 <ZCodeParameters>
3 <BLDConographOutput>
4 <!-- Bravais lattice with minimal distance.
5 (The distance between two unit cells is computed by
6 Trace((S-T)^2) := \sum_{1 <= i,j <= 3} (sij-tij)^2
7 using the Delone-reduced metric tensors S := (sij) and T := (tij) of their reciprocal lattices.)
8
9 CentringType NumberOfSolusions DistanceFromInputUnitCell : unit-cell parameters.
10 Cubic(F) 0
11 Cubic(I) 0
12 Cubic(P) 0
13 Hexagonal 1 9.8254e-002 : 2.3085e+001 2.3085e+001 1.0653e+001 9.0000e+001 9.0000e+001 1.2000e+002
14 Rhombohedral 0
15 Tetragonal(I) 0
16 Tetragonal(P) 0
17 Orthorhombic(F) 0
18 Orthorhombic(I) 0
19 Orthorhombic(C) 3 9.0828e-003 : 2.3156e+001 3.9623e+001 1.0653e+001 9.0000e+001 9.0000e+001 9.0000e+001
20 Orthorhombic(P) 0
21 Monoclinic(B) 6 6.3302e-003 : 3.9628e+001 2.3156e+001 1.0654e+001 9.0000e+001 9.0872e+001 9.0000e+001
22 Monoclinic(P) 1 9.8254e-002 : 2.2892e+001 1.0653e+001 2.3002e+001 9.0000e+001 1.1939e+002 9.0000e+001
23
24 -->
25
26
27 <!-- Candidates for Cubic(F) -->
28
29
30
31 <!-- Candidates for Cubic(I) -->
32
33
34
35 <!-- Candidates for Cubic(P) -->
36
37
38
39 <!-- Candidates for Hexagonal -->
40
41 <UnitCellCandidate number="1102">
42 <CrystalSystem> Hexagonal </CrystalSystem>
43
44 <!-- a, b, c(angstrom), alpha, beta, gamma(deg.)-->
45 <UnitCellParameters> 2.3085e+001 2.3085e+001 1.0653e+001 9.0000e+001 9.0000e+001 1.2000e+002 </UnitCellParameters>
46 <DistanceFromInputUnitCell> 9.8254e-002 </DistanceFromInputUnitCell>
47 </UnitCellCandidate>
48
49
50
51 <!-- Candidates for Rhombohedral -->
52
53
54
55 <!-- Candidates for Tetragonal(I) -->
56
57
58
59 <!-- Candidates for Tetragonal(P) -->
60
61
62
63 <!-- Candidates for Orthorhombic(F) -->
64
65
66
67 <!-- Candidates for Orthorhombic(I) -->
68
69
70
71 <!-- Candidates for Orthorhombic(C) -->
72
73 <UnitCellCandidate number="0504">
74 <CrystalSystem> Orthorhombic(C) </CrystalSystem>
75
76 <!-- a, b, c(angstrom), alpha, beta, gamma(deg.)-->
77 <UnitCellParameters> 2.3156e+001 3.9623e+001 1.0653e+001 9.0000e+001 9.0000e+001 9.0000e+001 </UnitCellParameters>
78 <DistanceFromInputUnitCell> 9.0828e-003 </DistanceFromInputUnitCell>
79 </UnitCellCandidate>
80
81 <UnitCellCandidate number="0504">
82 <CrystalSystem> Orthorhombic(C) </CrystalSystem>
83
84 <!-- a, b, c(angstrom), alpha, beta, gamma(deg.)-->
85 <UnitCellParameters> 2.2892e+001 4.0081e+001 1.0653e+001 9.0000e+001 9.0000e+001 9.0000e+001 </UnitCellParameters>
86 <DistanceFromInputUnitCell> 9.2717e-003 </DistanceFromInputUnitCell>
87 </UnitCellCandidate>
88
89 <UnitCellCandidate number="0504">
90 <CrystalSystem> Orthorhombic(C) </CrystalSystem>
91
92 <!-- a, b, c(angstrom), alpha, beta, gamma(deg.)-->
93 <UnitCellParameters> 2.3000e+001 3.9890e+001 1.0653e+001 9.0000e+001 9.0000e+001 9.0000e+001 </UnitCellParameters>
94 <DistanceFromInputUnitCell> 9.7489e-003 </DistanceFromInputUnitCell>
95 </UnitCellCandidate>
96
97
98
99 <!-- Candidates for Orthorhombic(P) -->
100
101
102
103 <!-- Candidates for Monoclinic(B) -->
104
105 <UnitCellCandidate number="0307">
106 <CrystalSystem> Monoclinic(B) </CrystalSystem>
107
108 <!-- a, b, c(angstrom), alpha, beta, gamma(deg.)-->
109 <UnitCellParameters> 3.9628e+001 2.3156e+001 1.0654e+001 9.0000e+001 9.0872e+001 9.0000e+001 </UnitCellParameters>
110 <DistanceFromInputUnitCell> 6.3302e-003 </DistanceFromInputUnitCell>
111 </UnitCellCandidate>
112
113 <UnitCellCandidate number="0307">
114 <CrystalSystem> Monoclinic(B) </CrystalSystem>
115
116 <!-- a, b, c(angstrom), alpha, beta, gamma(deg.)-->
117 <UnitCellParameters> 2.2894e+001 4.0081e+001 1.0654e+001 9.0000e+001 9.0883e+001 9.0000e+001 </UnitCellParameters>
118 <DistanceFromInputUnitCell> 6.3901e-003 </DistanceFromInputUnitCell>
119 </UnitCellCandidate>
120
121 <UnitCellCandidate number="0307">
122 <CrystalSystem> Monoclinic(B) </CrystalSystem>
123
124 <!-- a, b, c(angstrom), alpha, beta, gamma(deg.)-->
125 <UnitCellParameters> 2.3001e+001 3.9890e+001 1.0653e+001 9.0000e+001 9.0632e+001 9.0000e+001 </UnitCellParameters>
126 <DistanceFromInputUnitCell> 9.9659e-003 </DistanceFromInputUnitCell>
127 </UnitCellCandidate>
128
129 <UnitCellCandidate number="0307">
130 <CrystalSystem> Monoclinic(B) </CrystalSystem>
131
132 <!-- a, b, c(angstrom), alpha, beta, gamma(deg.)-->
133 <UnitCellParameters> 2.5327e+001 3.9623e+001 1.0327e+001 9.0000e+001 1.1390e+002 9.0000e+001 </UnitCellParameters>
134 <DistanceFromInputUnitCell> 4.1228e-002 </DistanceFromInputUnitCell>
135 </UnitCellCandidate>
136
137 <UnitCellCandidate number="0307">
138 <CrystalSystem> Monoclinic(B) </CrystalSystem>
139
140 <!-- a, b, c(angstrom), alpha, beta, gamma(deg.)-->
141 <UnitCellParameters> 2.5142e+001 3.9890e+001 1.0322e+001 9.0000e+001 1.1382e+002 9.0000e+001 </UnitCellParameters>
142 <DistanceFromInputUnitCell> 4.7522e-002 </DistanceFromInputUnitCell>
143 </UnitCellCandidate>
144
145 <UnitCellCandidate number="0307">
146 <CrystalSystem> Monoclinic(B) </CrystalSystem>
147
148 <!-- a, b, c(angstrom), alpha, beta, gamma(deg.)-->
149 <UnitCellParameters> 2.4985e+001 4.0081e+001 1.0306e+001 9.0000e+001 1.1362e+002 9.0000e+001 </UnitCellParameters>
150 <DistanceFromInputUnitCell> 4.7963e-002 </DistanceFromInputUnitCell>
151 </UnitCellCandidate>
152
153
154
155 <!-- Candidates for Monoclinic(P) -->
156
157 <UnitCellCandidate number="0202">
158 <CrystalSystem> Monoclinic(P) </CrystalSystem>
159
160 <!-- a, b, c(angstrom), alpha, beta, gamma(deg.)-->
161 <UnitCellParameters> 2.2892e+001 1.0653e+001 2.3002e+001 9.0000e+001 1.1939e+002 9.0000e+001 </UnitCellParameters>
162 <DistanceFromInputUnitCell> 9.8254e-002 </DistanceFromInputUnitCell>
163 </UnitCellCandidate>
164
165
166 </BLDConographOutput>
167 </ZCodeParameters>
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