1 #ifndef MCMD_STRUCTURE_FACTOR_P_GRID_H 2 #define MCMD_STRUCTURE_FACTOR_P_GRID_H 11 #include "StructureFactorP.h" 12 #include <util/crystal/LatticeSystem.h> 86 virtual void readParameters(std::istream& in);
108 template <
class Archive>
109 void serialize(Archive& ar,
const unsigned int version);
114 virtual void setup();
119 virtual void output();
148 template <
class Archive>
StructureFactorP evaluates partial structure factors in Fourier space.
A set of interacting Molecules enclosed by a Boundary.
void serialize(Archive &ar, PairSelector &selector, const unsigned int version)
Serialize a PairSelector.
Saving / output archive for binary ostream.
StructureFactorPGrid evaluates structure factors in Fourier space.
Utility classes for scientific computation.
void serialize(Archive &ar, const unsigned int version)
Serialize to/from an archive.
Saving archive for binary istream.
LatticeSystem
Enumeration of the 7 possible Bravais lattice systems.
Single-processor Monte Carlo (MC) and molecular dynamics (MD).
void serialize(Archive &ar, const unsigned int version)
Serialize to/from an archive.