146 |
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147 |
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148 |
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int Lattice::createOrthorhombicLattice(double latticeParameters[3]){ |
149 |
< |
double cell2; |
149 |
> |
double cellx2, celly2, cellz2; |
150 |
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double rroot3; |
151 |
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152 |
< |
cellLengthX = latticeParameter[0]; |
153 |
< |
cellLengthY = latticeParameter[1]; |
154 |
< |
cellLengthZ = latticeParameter[2]; |
152 |
> |
cellLengthX = latticeParameters[0]; |
153 |
> |
cellLengthY = latticeParameters[1]; |
154 |
> |
cellLengthZ = latticeParameters[2]; |
155 |
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156 |
< |
cellx2 = 0.5 * latticeParameter[0]; |
157 |
< |
cellx2 = 0.5 * latticeParameter[1]; |
158 |
< |
cellx2 = 0.5 * latticeParameter[2]; |
156 |
> |
cellx2 = 0.5 * latticeParameters[0]; |
157 |
> |
celly2 = 0.5 * latticeParameters[1]; |
158 |
> |
cellz2 = 0.5 * latticeParameters[2]; |
159 |
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rroot3 = 1.0 / sqrt(3.0); |
160 |
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161 |
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nCellSites = 4; |