| 12 |
|
protected: |
| 13 |
|
CubicLattice(); |
| 14 |
|
public: |
| 15 |
+ |
//get lattice constant of unit cell |
| 16 |
+ |
vector<double> getLatticeConstant(); |
| 17 |
|
|
| 18 |
+ |
//set lattice constant of unit cell |
| 19 |
+ |
void setLatticeConstant(const vector<double>& lc); |
| 20 |
+ |
protected: |
| 21 |
+ |
double latticeParam; |
| 22 |
|
}; |
| 23 |
|
|
| 24 |
|
|
| 25 |
|
class FCCLattice : public CubicLattice{ |
| 26 |
|
public: |
| 27 |
|
FCCLattice(); |
| 28 |
< |
virtual const string getLatticeType() {return FCCLatticeType;} |
| 29 |
< |
|
| 28 |
> |
virtual const string getLatticeType() {return FCCLatticeType;} |
| 29 |
> |
virtual void update(); |
| 30 |
> |
|
| 31 |
|
}; |
| 32 |
|
|
| 33 |
< |
|
| 33 |
> |
/* |
| 34 |
|
class BCCLattice : public CubicLattice{ |
| 35 |
|
public: |
| 36 |
|
BCCLattice(); |
| 49 |
|
OrthorhombicLattice(); |
| 50 |
|
virtual const string getLatticeType() {return OrthorhombicLatticeType;} |
| 51 |
|
}; |
| 52 |
+ |
*/ |
| 53 |
|
|
| 54 |
|
|
| 47 |
– |
|
| 55 |
|
#endif |