LatticeUtils Namespace Reference

Functions
Lattice	createFCCLattice (double lattice_constant, const ILatticeOrientation &orientation)
Lattice	createHCPLattice (double a, double c, const ILatticeOrientation &orientation)
Lattice	createBCTLattice (double a, double c, const ILatticeOrientation &orientation)

Function Documentation

createFCCLattice()

Lattice LatticeUtils::createFCCLattice	(	double	lattice_constant,
		const ILatticeOrientation &	orientation
	)

Definition at line 18 of file LatticeUtils.cpp.

{
    Lattice prim_cubic = Lattice::createCubicLattice(1.0);
    std::unique_ptr<ILatticeOrientation> P_orientation(orientation.clone());
    P_orientation->usePrimitiveLattice(prim_cubic);
    auto rotation = P_orientation->transformationMatrix();
    Lattice fcc = Lattice::createFCCLattice(lattice_constant);
    return fcc.createTransformedLattice(rotation);
}

References ILatticeOrientation::clone(), Lattice::createCubicLattice(), Lattice::createFCCLattice(), and Lattice::createTransformedLattice().

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createHCPLattice()

Lattice LatticeUtils::createHCPLattice	(	double	a,
		double	c,
		const ILatticeOrientation &	orientation
	)

Definition at line 29 of file LatticeUtils.cpp.

{
    Lattice prim_hexagonal = Lattice::createHexagonalLattice(1.0, c / a);
    std::unique_ptr<ILatticeOrientation> P_orientation(orientation.clone());
    P_orientation->usePrimitiveLattice(prim_hexagonal);
    auto rotation = P_orientation->transformationMatrix();
    Lattice hcp = Lattice::createHCPLattice(a, c);
    return hcp.createTransformedLattice(rotation);
}

References ILatticeOrientation::clone(), Lattice::createHCPLattice(), Lattice::createHexagonalLattice(), and Lattice::createTransformedLattice().

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createBCTLattice()

Lattice LatticeUtils::createBCTLattice	(	double	a,
		double	c,
		const ILatticeOrientation &	orientation
	)

Definition at line 39 of file LatticeUtils.cpp.

{
    Lattice prim_tetragonal = Lattice::createTetragonalLattice(1.0, c / a);
    std::unique_ptr<ILatticeOrientation> P_orientation(orientation.clone());
    P_orientation->usePrimitiveLattice(prim_tetragonal);
    auto rotation = P_orientation->transformationMatrix();
    Lattice hcp = Lattice::createBCTLattice(a, c);
    return hcp.createTransformedLattice(rotation);
}

References ILatticeOrientation::clone(), Lattice::createBCTLattice(), Lattice::createTetragonalLattice(), and Lattice::createTransformedLattice().

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