OpenMD 3.1
Molecular Dynamics in the Open
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Implements an ellipsoid-shaped lattice. More...
#include <shapedLatticeEllipsoid.hpp>
Public Member Functions | |
shapedLatticeEllipsoid (RealType latticeConstant, std::string latticeType, RealType rAxial, RealType rEquatorial) | |
virtual bool | isInterior (Vector3d point) |
Determines whether a point lies within an ellipsoid centered at origin (0,0,0) | |
Public Member Functions inherited from OpenMD::shapedLattice | |
shapedLattice (RealType latticeConstant, std::string latticeType) | |
void | setGridDimension (Vector3d dimension) |
setGridDimension: | |
void | setOrigin (Vector3d origin) |
std::vector< Vector3d > | getSites () |
std::vector< Vector3d > | getOrientations () |
Additional Inherited Members | |
Protected Member Functions inherited from OpenMD::shapedLattice | |
void | findSites () |
Protected Attributes inherited from OpenMD::shapedLattice | |
Vector3d | dimension_ |
Vector3d | origin_ |
Implements an ellipsoid-shaped lattice.
Definition at line 58 of file shapedLatticeEllipsoid.hpp.
OpenMD::shapedLatticeEllipsoid::shapedLatticeEllipsoid | ( | RealType | latticeConstant, |
std::string | latticeType, | ||
RealType | rAxial, | ||
RealType | rEquatorial ) |
Definition at line 54 of file shapedLatticeEllipsoid.cpp.
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virtual |
Determines whether a point lies within an ellipsoid centered at origin (0,0,0)
Implements OpenMD::shapedLattice.
Definition at line 79 of file shapedLatticeEllipsoid.cpp.