OpenMPCD
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Instrumentation for Harmonic Trimer fluids. More...
#include <HarmonicTrimers.hpp>
Public Member Functions | |
HarmonicTrimers (const Simulation *const sim, DeviceMemoryManager *const devMemMgr, const MPCFluid::HarmonicTrimers *const mpcFluid_) | |
The constructor. More... | |
virtual | ~HarmonicTrimers () |
The destructor. More... | |
void | measure () |
Performs measurements. More... | |
void | save (const std::string &rundir) const |
Saves the data to the given run directory. More... | |
const LogicalEntityMeanSquareDisplacement * | getLogicalEntityMeanSquareDisplacement () const |
Returns the LogicalEntityMeanSquareDisplacement instance, or nullptr if none was configured. More... | |
const NormalModeAutocorrelation * | getNormalModeAutocorrelation () const |
Returns the NormalModeAutocorrelation instance, or nullptr if none was configured. More... | |
Protected Member Functions | |
virtual void | measureSpecific () |
Performs measurements. More... | |
virtual void | saveSpecific (const std::string &rundir) const |
Saves the data to the given run directory. More... | |
Protected Attributes | |
FourierTransformedVelocity::Base * | fourierTransformedVelocity |
Measures Fourier-transformed velocities. More... | |
LogicalEntityMeanSquareDisplacement * | logicalEntityMeanSquareDisplacement |
Measures the mean square displacement of the centers of mass of the logical entities of the fluid. More... | |
NormalModeAutocorrelation * | normalModeAutocorrelation |
Measures the autocorrelation of normal mode coordinates. More... | |
VelocityAutocorrelation::Base * | velocityAutocorrelation |
Measures velocity autocorrelation. More... | |
Instrumentation for Harmonic Trimer fluids.
Definition at line 28 of file Instrumentation/HarmonicTrimers.hpp.
HarmonicTrimers::HarmonicTrimers | ( | const Simulation *const | sim, |
DeviceMemoryManager *const | devMemMgr, | ||
const MPCFluid::HarmonicTrimers *const | mpcFluid_ | ||
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The constructor.
[in] | sim | The simulation instance. |
[in] | devMemMgr | The Device memory manager. |
[in] | mpcFluid_ | The MPC fluid to measure. |
Definition at line 9 of file HarmonicTrimers.cpp.
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inlinevirtual |
The destructor.
Definition at line 44 of file Instrumentation/HarmonicTrimers.hpp.
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inlineinherited |
Returns the LogicalEntityMeanSquareDisplacement
instance, or nullptr
if none was configured.
Definition at line 129 of file CUDA/MPCFluid/Instrumentation/Base.hpp.
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inlineinherited |
Returns the NormalModeAutocorrelation
instance, or nullptr
if none was configured.
Definition at line 139 of file CUDA/MPCFluid/Instrumentation/Base.hpp.
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inlineinherited |
Performs measurements.
Definition at line 86 of file CUDA/MPCFluid/Instrumentation/Base.hpp.
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protectedvirtual |
Performs measurements.
Implements OpenMPCD::CUDA::MPCFluid::Instrumentation::Base.
Definition at line 46 of file HarmonicTrimers.cpp.
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inlineinherited |
Saves the data to the given run directory.
[in] | rundir | The path to the run directory. |
Definition at line 107 of file CUDA/MPCFluid/Instrumentation/Base.hpp.
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protectedvirtual |
Saves the data to the given run directory.
[in] | rundir | The path to the run directory. |
Implements OpenMPCD::CUDA::MPCFluid::Instrumentation::Base.
Definition at line 132 of file HarmonicTrimers.cpp.
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protectedinherited |
Measures Fourier-transformed velocities.
Definition at line 160 of file CUDA/MPCFluid/Instrumentation/Base.hpp.
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protectedinherited |
Measures the mean square displacement of the centers of mass of the logical entities of the fluid.
Definition at line 163 of file CUDA/MPCFluid/Instrumentation/Base.hpp.
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protectedinherited |
Measures the autocorrelation of normal mode coordinates.
Definition at line 167 of file CUDA/MPCFluid/Instrumentation/Base.hpp.
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protectedinherited |
Measures velocity autocorrelation.
Definition at line 169 of file CUDA/MPCFluid/Instrumentation/Base.hpp.